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Organic acids and derivatives

Organic compounds with acidic properties, and will commonly have carboxylic acids or similar functional groups in their structure. Derived compounds are also included.
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1

1-(3,5-Dichlorophenyl)-5-propyl-1H-pyrazole-4-carboxylic acid, 97%, Thermo Scientific™

CAS: 306936-60-7 Molecular Formula: C13H12Cl2N2O2 Molecular Weight (g/mol): 299.151 MDL Number: MFCD02677727 InChI Key: CIAUICOJDLJNBL-UHFFFAOYSA-N Synonym: 1-3,5-dichlorophenyl-5-propyl-1h-pyrazole-4-carboxylic acid,1-3,5-dichlorophenyl-5-propylpyrazole-4-carboxylic acid,1h-pyrazole-4-carboxylicacid, 1-3,5-dichlorophenyl-5-propyl,maybridge3_006729,4-carboxy-1-3,5-dichlorophenyl-5-propyl-1h-pyrazole PubChem CID: 2743017 IUPAC Name: 1-(3,5-dichlorophenyl)-5-propylpyrazole-4-carboxylic acid SMILES: CCCC1=C(C=NN1C2=CC(=CC(=C2)Cl)Cl)C(=O)O

PubChem CID 2743017
CAS 306936-60-7
Molecular Weight (g/mol) 299.151
MDL Number MFCD02677727
SMILES CCCC1=C(C=NN1C2=CC(=CC(=C2)Cl)Cl)C(=O)O
Synonym 1-3,5-dichlorophenyl-5-propyl-1h-pyrazole-4-carboxylic acid,1-3,5-dichlorophenyl-5-propylpyrazole-4-carboxylic acid,1h-pyrazole-4-carboxylicacid, 1-3,5-dichlorophenyl-5-propyl,maybridge3_006729,4-carboxy-1-3,5-dichlorophenyl-5-propyl-1h-pyrazole
IUPAC Name 1-(3,5-dichlorophenyl)-5-propylpyrazole-4-carboxylic acid
InChI Key CIAUICOJDLJNBL-UHFFFAOYSA-N
Molecular Formula C13H12Cl2N2O2
2

1-(4-Chlorophenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid, 97%, Thermo Scientific™

CAS: 98534-80-6 Molecular Formula: C11H6ClF3N2O2 Molecular Weight (g/mol): 290.626 MDL Number: MFCD00068142 InChI Key: HSZJMDBOSZVDOK-UHFFFAOYSA-N Synonym: 1-4-chlorophenyl-5-trifluoromethyl-1h-pyrazole-4-carboxylic acid,2-4-chlorophenyl-3-trifluoromethyl pyrazole-4-carboxylic acid,1-4-chlorophenyl-5-trifluoromethyl pyrazole-4-carboxylic acid,2-4-chlorophenyl-3-trifluoromethyl-2h-pyrazole-4-carboxylic acid,maybridge1_004008,2-4-chlorophenyl-3-trifluoromethyl pyrazole-4,1-4-chlorophenyl-5-trifluoromethyl-4-pyrazolecarboxylic acid,1h-pyrazole-4-carboxylic acid, 1-4-chlorophenyl-5-trifluoromethyl PubChem CID: 688687 IUPAC Name: 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid SMILES: C1=CC(=CC=C1N2C(=C(C=N2)C(=O)O)C(F)(F)F)Cl

PubChem CID 688687
CAS 98534-80-6
Molecular Weight (g/mol) 290.626
MDL Number MFCD00068142
SMILES C1=CC(=CC=C1N2C(=C(C=N2)C(=O)O)C(F)(F)F)Cl
Synonym 1-4-chlorophenyl-5-trifluoromethyl-1h-pyrazole-4-carboxylic acid,2-4-chlorophenyl-3-trifluoromethyl pyrazole-4-carboxylic acid,1-4-chlorophenyl-5-trifluoromethyl pyrazole-4-carboxylic acid,2-4-chlorophenyl-3-trifluoromethyl-2h-pyrazole-4-carboxylic acid,maybridge1_004008,2-4-chlorophenyl-3-trifluoromethyl pyrazole-4,1-4-chlorophenyl-5-trifluoromethyl-4-pyrazolecarboxylic acid,1h-pyrazole-4-carboxylic acid, 1-4-chlorophenyl-5-trifluoromethyl
IUPAC Name 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid
InChI Key HSZJMDBOSZVDOK-UHFFFAOYSA-N
Molecular Formula C11H6ClF3N2O2
3

methyl 4-amino-1-methyl-1H-pyrrole-2-carboxylate hydrochloride, Thermo Scientific™

CAS: 180258-45-1 Molecular Formula: C7H11ClN2O2 Molecular Weight (g/mol): 190.63 MDL Number: MFCD01318761 InChI Key: HEOKCJUUKIPIMM-UHFFFAOYSA-N Synonym: methyl 4-amino-1-methyl-1h-pyrrole-2-carboxylate hydrochloride,methyl 4-amino-1-methylpyrrole-2-carboxylate hydrochloride,methyl-4-amino-1-methyl pyrrole-2-carboxylate hydrochloride,4-amino-1-methyl-1h-pyrrole-2-carboxylic acid-methyl ester hcl,4-amino-1-methylpyrrole-2-carboxylic acid methyl ester hydrochloride,h-nh 4-mepyl-2-ome hcl,methyl 4-amino-1-methyl-pyrrole-2-carboxylate hydrochloride,methyl-4-amino-1-methyl pyrrole-2-carboxylate, hcl,n-methyl-2-carbomethoxy-4-aminopyrrole hydrochloride,3-amino-1-methyl-5-methyloxycarbonylpyrrol hydrochloride PubChem CID: 2794656 SMILES: Cl.COC(=O)C1=CC(N)=CN1C

PubChem CID 2794656
CAS 180258-45-1
Molecular Weight (g/mol) 190.63
MDL Number MFCD01318761
SMILES Cl.COC(=O)C1=CC(N)=CN1C
Synonym methyl 4-amino-1-methyl-1h-pyrrole-2-carboxylate hydrochloride,methyl 4-amino-1-methylpyrrole-2-carboxylate hydrochloride,methyl-4-amino-1-methyl pyrrole-2-carboxylate hydrochloride,4-amino-1-methyl-1h-pyrrole-2-carboxylic acid-methyl ester hcl,4-amino-1-methylpyrrole-2-carboxylic acid methyl ester hydrochloride,h-nh 4-mepyl-2-ome hcl,methyl 4-amino-1-methyl-pyrrole-2-carboxylate hydrochloride,methyl-4-amino-1-methyl pyrrole-2-carboxylate, hcl,n-methyl-2-carbomethoxy-4-aminopyrrole hydrochloride,3-amino-1-methyl-5-methyloxycarbonylpyrrol hydrochloride
InChI Key HEOKCJUUKIPIMM-UHFFFAOYSA-N
Molecular Formula C7H11ClN2O2
4

Isopropyl 2-bromo-2-methylpropanoate, 97%, Thermo Scientific™

CAS: 51368-55-9 Molecular Formula: C7H13BrO2 Molecular Weight (g/mol): 209.08 MDL Number: MFCD00055235 InChI Key: UNZJYKKJZGIFCG-UHFFFAOYSA-N Synonym: isopropyl 2-bromo-2-methylpropanoate,isopropyl 2-bromo-2-methylpropionate,2-bromo-2-methylpropionic acid isopropyl ester,isopropyl 2-bromoisobutyrate,propanoic acid, 2-bromo-2-methyl-, 1-methylethyl ester,isopropyl 2-bromo-2-methyl-propanoate,methylethyl 2-bromo-2-methylpropanoate,2-bromo-iso-butyric acid isopropyl ester,propan-2-yl 2-bromanyl-2-methyl-propanoate,2-bromoisobutyric acid isopropyl ester PubChem CID: 2796293 IUPAC Name: propan-2-yl 2-bromo-2-methylpropanoate SMILES: CC(C)OC(=O)C(C)(C)Br

PubChem CID 2796293
CAS 51368-55-9
Molecular Weight (g/mol) 209.08
MDL Number MFCD00055235
SMILES CC(C)OC(=O)C(C)(C)Br
Synonym isopropyl 2-bromo-2-methylpropanoate,isopropyl 2-bromo-2-methylpropionate,2-bromo-2-methylpropionic acid isopropyl ester,isopropyl 2-bromoisobutyrate,propanoic acid, 2-bromo-2-methyl-, 1-methylethyl ester,isopropyl 2-bromo-2-methyl-propanoate,methylethyl 2-bromo-2-methylpropanoate,2-bromo-iso-butyric acid isopropyl ester,propan-2-yl 2-bromanyl-2-methyl-propanoate,2-bromoisobutyric acid isopropyl ester
IUPAC Name propan-2-yl 2-bromo-2-methylpropanoate
InChI Key UNZJYKKJZGIFCG-UHFFFAOYSA-N
Molecular Formula C7H13BrO2
5

Methyle4-methoxythiophene-3-carboxylate, 97%, Thermo Scientific™

CAS: 65369-22-4 Molecular Formula: C7H8O3S Molecular Weight (g/mol): 172.198 MDL Number: MFCD00067995 InChI Key: LQIVVUILGDRRHE-UHFFFAOYSA-N Synonym: methyl 4-methoxy-3-thiophenecarboxylate,4-methoxy-thiophene-3-carboxylic acid methyl ester,3-thiophenecarboxylic acid, 4-methoxy-, methyl ester,maybridge1_004625,ksc495s3h,methyl 4-methoxythiophene-3-arboxylate,3-methoxythiophene-4-carboxylic acid methyl ester,3-thiophenecarboxylicacid,4-methoxy-,methyl ester,4-methoxy-3-thiophenecarboxylic acid methyl ester,3-thiophenecarboxylicacid, 4-methoxy-, methyl ester PubChem CID: 2778377 IUPAC Name: methyl 4-methoxythiophene-3-carboxylate SMILES: COC1=CSC=C1C(=O)OC

PubChem CID 2778377
CAS 65369-22-4
Molecular Weight (g/mol) 172.198
MDL Number MFCD00067995
SMILES COC1=CSC=C1C(=O)OC
Synonym methyl 4-methoxy-3-thiophenecarboxylate,4-methoxy-thiophene-3-carboxylic acid methyl ester,3-thiophenecarboxylic acid, 4-methoxy-, methyl ester,maybridge1_004625,ksc495s3h,methyl 4-methoxythiophene-3-arboxylate,3-methoxythiophene-4-carboxylic acid methyl ester,3-thiophenecarboxylicacid,4-methoxy-,methyl ester,4-methoxy-3-thiophenecarboxylic acid methyl ester,3-thiophenecarboxylicacid, 4-methoxy-, methyl ester
IUPAC Name methyl 4-methoxythiophene-3-carboxylate
InChI Key LQIVVUILGDRRHE-UHFFFAOYSA-N
Molecular Formula C7H8O3S
6

Methyle1H-benzimidazole-5-carboxylate, 97%, Thermo Scientific™

CAS: 26663-77-4 Molecular Formula: C9H8N2O2 Molecular Weight (g/mol): 176.175 MDL Number: MFCD03407310 InChI Key: WJHHIVYNOVTVGY-UHFFFAOYSA-N Synonym: methyl benzimidazole-5-carboxylate,methyl 1h-benzimidazole-5-carboxylate,methyl 1h-benzo d imidazole-5-carboxylate,methyl 1h-1,3-benzodiazole-5-carboxylate,1h-benzimidazole-5-carboxylicacidmethylester,1h-benzimidazole-5-carboxylic acid methyl ester,methyl 1h-benzo d imidazole-6-carboxylate,benzimidazole-5-carboxylic acid methyl ester,1h-benzoimidazole-5-carboxylic acid methyl ester,1h-benzimidazole-5-carboxylic acid, methyl ester PubChem CID: 2779733 IUPAC Name: methyl 3H-benzimidazole-5-carboxylate SMILES: COC(=O)C1=CC2=C(C=C1)N=CN2

PubChem CID 2779733
CAS 26663-77-4
Molecular Weight (g/mol) 176.175
MDL Number MFCD03407310
SMILES COC(=O)C1=CC2=C(C=C1)N=CN2
Synonym methyl benzimidazole-5-carboxylate,methyl 1h-benzimidazole-5-carboxylate,methyl 1h-benzo d imidazole-5-carboxylate,methyl 1h-1,3-benzodiazole-5-carboxylate,1h-benzimidazole-5-carboxylicacidmethylester,1h-benzimidazole-5-carboxylic acid methyl ester,methyl 1h-benzo d imidazole-6-carboxylate,benzimidazole-5-carboxylic acid methyl ester,1h-benzoimidazole-5-carboxylic acid methyl ester,1h-benzimidazole-5-carboxylic acid, methyl ester
IUPAC Name methyl 3H-benzimidazole-5-carboxylate
InChI Key WJHHIVYNOVTVGY-UHFFFAOYSA-N
Molecular Formula C9H8N2O2
7

Methyl 3-hydrazinothiophene-2-carboxylate, 97%, Thermo Scientific™

CAS: 75681-13-9 Molecular Formula: C6H8N2O2S Molecular Weight (g/mol): 172.202 MDL Number: MFCD00052080 InChI Key: RWGYQWWIXLVGDJ-UHFFFAOYSA-N Synonym: methyl 3-hydrazinothiophene-2-carboxylate,2-thiophenecarboxylicacid, 3-hydrazinyl-, methyl ester,3-hydrazino-2-thiophenecarboxylic acid methyl ester,3-hydrazinothiophene-2-carboxylic acid methyl ester,3-hydrazino thiophene-2-carboxylic acid methyl ester PubChem CID: 2777595 IUPAC Name: methyl 3-hydrazinylthiophene-2-carboxylate SMILES: COC(=O)C1=C(C=CS1)NN

PubChem CID 2777595
CAS 75681-13-9
Molecular Weight (g/mol) 172.202
MDL Number MFCD00052080
SMILES COC(=O)C1=C(C=CS1)NN
Synonym methyl 3-hydrazinothiophene-2-carboxylate,2-thiophenecarboxylicacid, 3-hydrazinyl-, methyl ester,3-hydrazino-2-thiophenecarboxylic acid methyl ester,3-hydrazinothiophene-2-carboxylic acid methyl ester,3-hydrazino thiophene-2-carboxylic acid methyl ester
IUPAC Name methyl 3-hydrazinylthiophene-2-carboxylate
InChI Key RWGYQWWIXLVGDJ-UHFFFAOYSA-N
Molecular Formula C6H8N2O2S
8

1-Methyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid, 97%, Thermo Scientific™

CAS: 113100-53-1 Molecular Formula: C6H5F3N2O2 Molecular Weight (g/mol): 194.113 MDL Number: MFCD01936005 InChI Key: FZNKJQNEJGXCJH-UHFFFAOYSA-N Synonym: 1-methyl-3-trifluoromethyl-1h-pyrazole-4-carboxylic acid,1-methyl-3-trifluoromethyl pyrazole-4-carboxylic acid,3-trifluoromethyl-1-methyl-1h-pyrazole-4-carboxylic acid,1-methyl-3-trifluoromethyl-4-pyrazolecarboxylic acid,1-methyl-3-trifluoromethyl-1h-pyrazole-4-carboxy,1h-pyrazole-4-carboxylic acid, 1-methyl-3-trifluoromethyl,pubchem11402,acmc-1bscj,ksc183q3j PubChem CID: 2775665 IUPAC Name: 1-methyl-3-(trifluoromethyl)pyrazole-4-carboxylic acid SMILES: CN1C=C(C(=N1)C(F)(F)F)C(=O)O

PubChem CID 2775665
CAS 113100-53-1
Molecular Weight (g/mol) 194.113
MDL Number MFCD01936005
SMILES CN1C=C(C(=N1)C(F)(F)F)C(=O)O
Synonym 1-methyl-3-trifluoromethyl-1h-pyrazole-4-carboxylic acid,1-methyl-3-trifluoromethyl pyrazole-4-carboxylic acid,3-trifluoromethyl-1-methyl-1h-pyrazole-4-carboxylic acid,1-methyl-3-trifluoromethyl-4-pyrazolecarboxylic acid,1-methyl-3-trifluoromethyl-1h-pyrazole-4-carboxy,1h-pyrazole-4-carboxylic acid, 1-methyl-3-trifluoromethyl,pubchem11402,acmc-1bscj,ksc183q3j
IUPAC Name 1-methyl-3-(trifluoromethyl)pyrazole-4-carboxylic acid
InChI Key FZNKJQNEJGXCJH-UHFFFAOYSA-N
Molecular Formula C6H5F3N2O2
9

Methyle2-aminothiophene-3-carboxylate, 97%, Thermo Scientific™

CAS: 4651-81-4 Molecular Formula: C6H7NO2S Molecular Weight (g/mol): 157.19 MDL Number: MFCD00159547 InChI Key: DGGJQLCAYQCPDD-UHFFFAOYSA-N Synonym: methyl 2-amino-3-thenoate,methyl 2-amino-3-thiophenecarboxylate,2-amino-3-methoxycarbonylthiophene,methyl2-aminothiophene-3-carboxylate,2-amino-thiophene-3-carboxylic acid methyl ester,3-thiophenecarboxylic acid, 2-amino-, methyl ester,zlchem 402,pubchem5551,maybridge1_003714,2-amino-thiophene-3-carboxylicacidmethylester PubChem CID: 78381 IUPAC Name: methyl 2-aminothiophene-3-carboxylate SMILES: COC(=O)C1=C(N)SC=C1

PubChem CID 78381
CAS 4651-81-4
Molecular Weight (g/mol) 157.19
MDL Number MFCD00159547
SMILES COC(=O)C1=C(N)SC=C1
Synonym methyl 2-amino-3-thenoate,methyl 2-amino-3-thiophenecarboxylate,2-amino-3-methoxycarbonylthiophene,methyl2-aminothiophene-3-carboxylate,2-amino-thiophene-3-carboxylic acid methyl ester,3-thiophenecarboxylic acid, 2-amino-, methyl ester,zlchem 402,pubchem5551,maybridge1_003714,2-amino-thiophene-3-carboxylicacidmethylester
IUPAC Name methyl 2-aminothiophene-3-carboxylate
InChI Key DGGJQLCAYQCPDD-UHFFFAOYSA-N
Molecular Formula C6H7NO2S
10

2-(Propylthio)pyridine-3-carbonyl chloride, 97%, Thermo Scientific™

CAS: 175135-24-7 Molecular Formula: C9H10ClNOS Molecular Weight (g/mol): 215.70 MDL Number: MFCD00052656 InChI Key: FTEUTJYYROCUBI-UHFFFAOYSA-N Synonym: 2-propylthio pyridine-3-carbonyl chloride,2-propylsulfanyl pyridine-3-carbonyl chloride,2-propylthio nicotinoyl chloride,2-propylthiopyridine-3-carbonyl chloride,3-pyridinecarbonylchloride, 2-propylthio,2-propylthio pyridine-3-carbonylchloride PubChem CID: 2774530 IUPAC Name: 2-propylsulfanylpyridine-3-carbonyl chloride SMILES: CCCSC1=C(C=CC=N1)C(Cl)=O

PubChem CID 2774530
CAS 175135-24-7
Molecular Weight (g/mol) 215.70
MDL Number MFCD00052656
SMILES CCCSC1=C(C=CC=N1)C(Cl)=O
Synonym 2-propylthio pyridine-3-carbonyl chloride,2-propylsulfanyl pyridine-3-carbonyl chloride,2-propylthio nicotinoyl chloride,2-propylthiopyridine-3-carbonyl chloride,3-pyridinecarbonylchloride, 2-propylthio,2-propylthio pyridine-3-carbonylchloride
IUPAC Name 2-propylsulfanylpyridine-3-carbonyl chloride
InChI Key FTEUTJYYROCUBI-UHFFFAOYSA-N
Molecular Formula C9H10ClNOS
11

3,5-Dimethyl-1-phenyl-1H-pyrazole-4-carboxylic acid, 97%, Thermo Scientific™

CAS: 61226-19-5 Molecular Formula: C12H11N2O2 Molecular Weight (g/mol): 215.23 MDL Number: MFCD02656670 InChI Key: LPYTYYLNGJGJGW-UHFFFAOYSA-M Synonym: 3,5-dimethyl-1-phenyl-1h-pyrazole-4-carboxylic acid,3,5-dimethyl-1-phenyl-1h-pyrazole-4-carboxylicacid,4-carboxy-3,5-dimethyl-1-phenyl-1h-pyrazole,1h-pyrazole-4-carboxylicacid,3,5-dimethyl-1-phenyl,1h-pyrazole-4-carboxylicacid, 3,5-dimethyl-1-phenyl,3,5-dimethyl-1-phenyl-1h-pyrazole-4-carbox ylic acid PubChem CID: 612275 SMILES: CC1=NN(C(C)=C1C([O-])=O)C1=CC=CC=C1

PubChem CID 612275
CAS 61226-19-5
Molecular Weight (g/mol) 215.23
MDL Number MFCD02656670
SMILES CC1=NN(C(C)=C1C([O-])=O)C1=CC=CC=C1
Synonym 3,5-dimethyl-1-phenyl-1h-pyrazole-4-carboxylic acid,3,5-dimethyl-1-phenyl-1h-pyrazole-4-carboxylicacid,4-carboxy-3,5-dimethyl-1-phenyl-1h-pyrazole,1h-pyrazole-4-carboxylicacid,3,5-dimethyl-1-phenyl,1h-pyrazole-4-carboxylicacid, 3,5-dimethyl-1-phenyl,3,5-dimethyl-1-phenyl-1h-pyrazole-4-carbox ylic acid
InChI Key LPYTYYLNGJGJGW-UHFFFAOYSA-M
Molecular Formula C12H11N2O2
12

5-Methyl-1-phenyl-1H-pyrazole-4-carboxylic acid, 97%, Thermo Scientific™

CAS: 91138-00-0 Molecular Formula: C11H10N2O2 Molecular Weight (g/mol): 202.213 InChI Key: USSMIQWDLWJQDQ-UHFFFAOYSA-N Synonym: 5-methyl-1-phenyl-1h-pyrazole-4-carboxylic acid,3-methyl-2-phenylpyrazole-4-carboxylic acid,3-methyl-2-phenyl-4-pyrazolecarboxylic acid,akos pao-0331,acmc-20am2c,rarechem al be 1317,maybridge1_002413,buttpark 33\08-16,cbi-bb zero/006129,5-methyl-1-phenyl-1h-pyrazole-4-carboxylicacid PubChem CID: 145221 IUPAC Name: 5-methyl-1-phenylpyrazole-4-carboxylic acid SMILES: CC1=C(C=NN1C2=CC=CC=C2)C(=O)O

PubChem CID 145221
CAS 91138-00-0
Molecular Weight (g/mol) 202.213
SMILES CC1=C(C=NN1C2=CC=CC=C2)C(=O)O
Synonym 5-methyl-1-phenyl-1h-pyrazole-4-carboxylic acid,3-methyl-2-phenylpyrazole-4-carboxylic acid,3-methyl-2-phenyl-4-pyrazolecarboxylic acid,akos pao-0331,acmc-20am2c,rarechem al be 1317,maybridge1_002413,buttpark 33\08-16,cbi-bb zero/006129,5-methyl-1-phenyl-1h-pyrazole-4-carboxylicacid
IUPAC Name 5-methyl-1-phenylpyrazole-4-carboxylic acid
InChI Key USSMIQWDLWJQDQ-UHFFFAOYSA-N
Molecular Formula C11H10N2O2
13

Ethyl 5-amino-1-methylpyrazole-4-carboxylate, 97%, Thermo Scientific™

CAS: 31037-02-2 Molecular Formula: C7H11N3O2 Molecular Weight (g/mol): 169.18 MDL Number: MFCD00051652 InChI Key: MEUSJJFWVKBUFP-UHFFFAOYSA-N Synonym: ethyl 5-amino-1-methyl-1h-pyrazole-4-carboxylate,5-amino-1-methyl-1h-pyrazole-4-carboxylic acid ethyl ester,ethyl5-amino-1-methylpyrazole-4-carboxylate,1h-pyrazole-4-carboxylic acid, 5-amino-1-methyl-, ethyl ester,5-amino-1-methylpyrazole-4-carboxylic acid ethyl ester,ethyl 5-amino-1-methyl-4-pyrazolecarboxylate,ethyl 5-amino-1-methyl-pyrazole-4-carboxylate,acmc-1agpk,maybridge1_003833,ethyl-5-amino-1-methyl-1h-pyrazol-4-carboxylat PubChem CID: 271299 SMILES: CCOC(=O)C1=C(N)N(C)N=C1

PubChem CID 271299
CAS 31037-02-2
Molecular Weight (g/mol) 169.18
MDL Number MFCD00051652
SMILES CCOC(=O)C1=C(N)N(C)N=C1
Synonym ethyl 5-amino-1-methyl-1h-pyrazole-4-carboxylate,5-amino-1-methyl-1h-pyrazole-4-carboxylic acid ethyl ester,ethyl5-amino-1-methylpyrazole-4-carboxylate,1h-pyrazole-4-carboxylic acid, 5-amino-1-methyl-, ethyl ester,5-amino-1-methylpyrazole-4-carboxylic acid ethyl ester,ethyl 5-amino-1-methyl-4-pyrazolecarboxylate,ethyl 5-amino-1-methyl-pyrazole-4-carboxylate,acmc-1agpk,maybridge1_003833,ethyl-5-amino-1-methyl-1h-pyrazol-4-carboxylat
InChI Key MEUSJJFWVKBUFP-UHFFFAOYSA-N
Molecular Formula C7H11N3O2
14

Methyle3-hydroxybenzo[b]thiophene-2-carboxylate, 97%, Thermo Scientific™

CAS: 13134-76-4 Molecular Formula: C10H8O3S Molecular Weight (g/mol): 208.23 MDL Number: MFCD00067732 InChI Key: JVUOTPTULVZUTL-KTKRTIGZSA-N Synonym: methyl 3-hydroxybenzo b thiophene-2-carboxylate,methyl 3-hydroxybenzo b thiophene-3-carboxylate,2-hydroxy methoxy methylidene-1-benzothiophen-3-one,2z-2-hydroxy methoxy methylidene-1-benzothiophen-3-one,benzo b thiophene-2-carboxylicacid, 3-hydroxy-, methyl ester,benzo b thiophene-2-carboxylic acid, 3-hydroxy-, methyl ester,maybridge4_000295,methyl 3-hydroxy-benzothiophene2-carboxylate PubChem CID: 83165 SMILES: CO\C(O)=C1/SC2=CC=CC=C2C1=O

PubChem CID 83165
CAS 13134-76-4
Molecular Weight (g/mol) 208.23
MDL Number MFCD00067732
SMILES CO\C(O)=C1/SC2=CC=CC=C2C1=O
Synonym methyl 3-hydroxybenzo b thiophene-2-carboxylate,methyl 3-hydroxybenzo b thiophene-3-carboxylate,2-hydroxy methoxy methylidene-1-benzothiophen-3-one,2z-2-hydroxy methoxy methylidene-1-benzothiophen-3-one,benzo b thiophene-2-carboxylicacid, 3-hydroxy-, methyl ester,benzo b thiophene-2-carboxylic acid, 3-hydroxy-, methyl ester,maybridge4_000295,methyl 3-hydroxy-benzothiophene2-carboxylate
InChI Key JVUOTPTULVZUTL-KTKRTIGZSA-N
Molecular Formula C10H8O3S
15

1-Phenyl-5-propyl-1H-pyrazole-4-carboxylic acid, 97%, Thermo Scientific™

CAS: 116344-17-3 Molecular Formula: C13H14N2O2 Molecular Weight (g/mol): 230.267 MDL Number: MFCD00068140 InChI Key: CBYITWPSSDTYTN-UHFFFAOYSA-N PubChem CID: 2777578 IUPAC Name: 1-phenyl-5-propylpyrazole-4-carboxylic acid SMILES: CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)O

PubChem CID 2777578
CAS 116344-17-3
Molecular Weight (g/mol) 230.267
MDL Number MFCD00068140
SMILES CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)O
IUPAC Name 1-phenyl-5-propylpyrazole-4-carboxylic acid
InChI Key CBYITWPSSDTYTN-UHFFFAOYSA-N
Molecular Formula C13H14N2O2