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Carboxylic acid esters

Organic compounds that are directly derived from carboxylic acid, and contain an ester functional group substitution; ester groups contain an oxygen atom that is bonded to two carbon atoms or organic groups via single bonds.
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1 – 15 of 16 results
1

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
3

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
4

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
5

Methyl 3-(2-morpholin-4-ylethoxy)benzoate, 97%, Thermo Scientific™

CAS: 249937-00-6 Molecular Formula: C14H19NO4 Molecular Weight (g/mol): 265.31 MDL Number: MFCD08060518 InChI Key: VOYSHDFODOJUMP-UHFFFAOYSA-N Synonym: methyl 3-2-morpholin-4-ylethoxy benzoate,methyl 3-2-morpholin-4-yl ethoxy benzoate,methyl 3-2-morpholinoethoxy benzoate,methyl 3-2-morpholin4-ylethoxy benzoate,3-2-morpholin-4-yl-ethoxy-benzoic acid methyl ester,benzoic acid,3-2-4-morpholinyl ethoxy-, methyl ester PubChem CID: 7164628 IUPAC Name: methyl 3-(2-morpholin-4-ylethoxy)benzoate SMILES: COC(=O)C1=CC(OCCN2CCOCC2)=CC=C1

PubChem CID 7164628
CAS 249937-00-6
Molecular Weight (g/mol) 265.31
MDL Number MFCD08060518
SMILES COC(=O)C1=CC(OCCN2CCOCC2)=CC=C1
Synonym methyl 3-2-morpholin-4-ylethoxy benzoate,methyl 3-2-morpholin-4-yl ethoxy benzoate,methyl 3-2-morpholinoethoxy benzoate,methyl 3-2-morpholin4-ylethoxy benzoate,3-2-morpholin-4-yl-ethoxy-benzoic acid methyl ester,benzoic acid,3-2-4-morpholinyl ethoxy-, methyl ester
IUPAC Name methyl 3-(2-morpholin-4-ylethoxy)benzoate
InChI Key VOYSHDFODOJUMP-UHFFFAOYSA-N
Molecular Formula C14H19NO4
6

Methylequinoxaline-6-carboxylate, 97%, Thermo Scientific™

CAS: 23088-23-5 Molecular Formula: C10H8N2O2 Molecular Weight (g/mol): 188.19 MDL Number: MFCD00102618 InChI Key: VFPWJISMXACHIG-UHFFFAOYSA-N Synonym: methyl 6-quinoxalinecarboxylate,6-quinoxalinecarboxylic acid, methyl ester,maybridge1_006081,acmc-1cnh9,methyl6-quinoxalinecarboxylate,methyl quinoxaline-7-carboxylate,6-quinoxalinecarboxylic acid methyl ester,6-quinoxalinecarboxylicacid, methyl ester,6-quinoxalinecarboxylic acid methyl ester; PubChem CID: 2781239 IUPAC Name: methyl quinoxaline-6-carboxylate SMILES: COC(=O)C1=CC=C2N=CC=NC2=C1

PubChem CID 2781239
CAS 23088-23-5
Molecular Weight (g/mol) 188.19
MDL Number MFCD00102618
SMILES COC(=O)C1=CC=C2N=CC=NC2=C1
Synonym methyl 6-quinoxalinecarboxylate,6-quinoxalinecarboxylic acid, methyl ester,maybridge1_006081,acmc-1cnh9,methyl6-quinoxalinecarboxylate,methyl quinoxaline-7-carboxylate,6-quinoxalinecarboxylic acid methyl ester,6-quinoxalinecarboxylicacid, methyl ester,6-quinoxalinecarboxylic acid methyl ester;
IUPAC Name methyl quinoxaline-6-carboxylate
InChI Key VFPWJISMXACHIG-UHFFFAOYSA-N
Molecular Formula C10H8N2O2
7

Methyl propiolate, 97%, Thermo Scientific™

CAS: 922-67-8 Molecular Formula: C4H4O2 Molecular Weight (g/mol): 84.074 MDL Number: MFCD00008572 InChI Key: IMAKHNTVDGLIRY-UHFFFAOYSA-N Synonym: methyl propiolate,methyl propynoate,2-propynoic acid, methyl ester,propiolic acid, methyl ester,methyl acetylenecarboxylate,methyl ethynecarboxylate,propynoic acid, methyl ester,propynoic acid methyl ester,methyl propargylate,acetylenecarboxylic acid methyl ester PubChem CID: 13536 IUPAC Name: methyl prop-2-ynoate SMILES: COC(=O)C#C

PubChem CID 13536
CAS 922-67-8
Molecular Weight (g/mol) 84.074
MDL Number MFCD00008572
SMILES COC(=O)C#C
Synonym methyl propiolate,methyl propynoate,2-propynoic acid, methyl ester,propiolic acid, methyl ester,methyl acetylenecarboxylate,methyl ethynecarboxylate,propynoic acid, methyl ester,propynoic acid methyl ester,methyl propargylate,acetylenecarboxylic acid methyl ester
IUPAC Name methyl prop-2-ynoate
InChI Key IMAKHNTVDGLIRY-UHFFFAOYSA-N
Molecular Formula C4H4O2
8

Methyle3-cyanobenzoate, 95%, Thermo Scientific™

CAS: 13531-48-1 Molecular Formula: C9H7NO2 Molecular Weight (g/mol): 161.16 MDL Number: MFCD00220156 InChI Key: XPBHWSMZTSSEJE-UHFFFAOYSA-N Synonym: methyl m-cyanobenzoate,benzoic acid, 3-cyano-, methyl ester,3-cyanobenzoic acid methyl ester,methyl-3-cyanobenzoate,methyl3-cyanobenzoate,pubchem21088,acmc-1burk,intermediates-zcf02042,ksc180c9j,3-cn-c6h4-cooch3 PubChem CID: 83554 IUPAC Name: methyl 3-cyanobenzoate SMILES: COC(=O)C1=CC=CC(=C1)C#N

PubChem CID 83554
CAS 13531-48-1
Molecular Weight (g/mol) 161.16
MDL Number MFCD00220156
SMILES COC(=O)C1=CC=CC(=C1)C#N
Synonym methyl m-cyanobenzoate,benzoic acid, 3-cyano-, methyl ester,3-cyanobenzoic acid methyl ester,methyl-3-cyanobenzoate,methyl3-cyanobenzoate,pubchem21088,acmc-1burk,intermediates-zcf02042,ksc180c9j,3-cn-c6h4-cooch3
IUPAC Name methyl 3-cyanobenzoate
InChI Key XPBHWSMZTSSEJE-UHFFFAOYSA-N
Molecular Formula C9H7NO2
9

Methyl 3-[3-(dimethylamino)propoxy]benzoate, 97%, Thermo Scientific™

CAS: 921938-75-2 Molecular Formula: C13H19NO3 Molecular Weight (g/mol): 237.299 MDL Number: MFCD09702393 InChI Key: WGAZXKVAWOAUOI-UHFFFAOYSA-N Synonym: methyl 3-3-dimethylamino propoxy benzoate PubChem CID: 24229605 IUPAC Name: methyl 3-[3-(dimethylamino)propoxy]benzoate SMILES: CN(C)CCCOC1=CC=CC(=C1)C(=O)OC

PubChem CID 24229605
CAS 921938-75-2
Molecular Weight (g/mol) 237.299
MDL Number MFCD09702393
SMILES CN(C)CCCOC1=CC=CC(=C1)C(=O)OC
Synonym methyl 3-3-dimethylamino propoxy benzoate
IUPAC Name methyl 3-[3-(dimethylamino)propoxy]benzoate
InChI Key WGAZXKVAWOAUOI-UHFFFAOYSA-N
Molecular Formula C13H19NO3
11

Methyle4-(trifluoromethoxy)benzoate, 97%, Thermo Scientific™

CAS: 780-31-4 Molecular Formula: C9H7F3O3 Molecular Weight (g/mol): 220.147 MDL Number: MFCD00041006 InChI Key: JFFLBWZTJAWGNP-UHFFFAOYSA-N PubChem CID: 737353 IUPAC Name: methyl 4-(trifluoromethoxy)benzoate SMILES: COC(=O)C1=CC=C(C=C1)OC(F)(F)F

PubChem CID 737353
CAS 780-31-4
Molecular Weight (g/mol) 220.147
MDL Number MFCD00041006
SMILES COC(=O)C1=CC=C(C=C1)OC(F)(F)F
IUPAC Name methyl 4-(trifluoromethoxy)benzoate
InChI Key JFFLBWZTJAWGNP-UHFFFAOYSA-N
Molecular Formula C9H7F3O3
12

Methyl 4-[3-(dimethylamino)propoxy]benzoate, 97%, Thermo Scientific™

CAS: 190660-97-0 Molecular Formula: C13H19NO3 Molecular Weight (g/mol): 237.30 MDL Number: MFCD06203847 InChI Key: SRXQDDFKGDLAJM-UHFFFAOYSA-N Synonym: methyl 4-3-dimethylamino propoxy benzoate,4-3-dimethylamino-propoxy-benzoic acid methyl ester,methyl 4-3-n,n-dimethylamino-1-propyloxy benzoate,methyl-4-3-n,n-dimethylamino-1-propyloxy benzoate PubChem CID: 18508114 IUPAC Name: methyl 4-[3-(dimethylamino)propoxy]benzoate SMILES: COC(=O)C1=CC=C(OCCCN(C)C)C=C1

PubChem CID 18508114
CAS 190660-97-0
Molecular Weight (g/mol) 237.30
MDL Number MFCD06203847
SMILES COC(=O)C1=CC=C(OCCCN(C)C)C=C1
Synonym methyl 4-3-dimethylamino propoxy benzoate,4-3-dimethylamino-propoxy-benzoic acid methyl ester,methyl 4-3-n,n-dimethylamino-1-propyloxy benzoate,methyl-4-3-n,n-dimethylamino-1-propyloxy benzoate
IUPAC Name methyl 4-[3-(dimethylamino)propoxy]benzoate
InChI Key SRXQDDFKGDLAJM-UHFFFAOYSA-N
Molecular Formula C13H19NO3
13

methyl 2-[1-methyl-3-(trifluoromethyl)-1h-pyrazol-5-yl]benzoate, 90%, Thermo Scientific™

CAS: 898289-62-8 Molecular Formula: C13H11F3N2O2 Molecular Weight (g/mol): 284.238 MDL Number: MFCD09879929 InChI Key: VBXXEOGWKRJBBH-UHFFFAOYSA-N Synonym: methyl 2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl benzoate,methyl 2-2-methyl-5-trifluoromethyl pyrazol-3-yl benzoate,2-2-methyl-5-trifluoromethyl-3-pyrazolyl benzoic acid methyl ester,5-2-methoxycarbonyl phenyl-1-methyl-3-trifluoromethyl-1h-pyrazole,benzoic acid,2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl-, methyl ester PubChem CID: 24229663 IUPAC Name: methyl 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzoate SMILES: CN1C(=CC(=N1)C(F)(F)F)C2=CC=CC=C2C(=O)OC

PubChem CID 24229663
CAS 898289-62-8
Molecular Weight (g/mol) 284.238
MDL Number MFCD09879929
SMILES CN1C(=CC(=N1)C(F)(F)F)C2=CC=CC=C2C(=O)OC
Synonym methyl 2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl benzoate,methyl 2-2-methyl-5-trifluoromethyl pyrazol-3-yl benzoate,2-2-methyl-5-trifluoromethyl-3-pyrazolyl benzoic acid methyl ester,5-2-methoxycarbonyl phenyl-1-methyl-3-trifluoromethyl-1h-pyrazole,benzoic acid,2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl-, methyl ester
IUPAC Name methyl 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzoate
InChI Key VBXXEOGWKRJBBH-UHFFFAOYSA-N
Molecular Formula C13H11F3N2O2
14

Methyl 4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoate, 97%, Thermo Scientific™

CAS: 209912-44-7 Molecular Formula: C11H10N2O3 Molecular Weight (g/mol): 218.212 MDL Number: MFCD08690288 InChI Key: PJYMNVKGDLTDJE-UHFFFAOYSA-N Synonym: methyl 4-3-methyl-1,2,4-oxadiazol-5-yl benzoate,4-3-methyl-1,2,4-oxadiazole-5-yl benzoic acid methyl ester,benzoicacid, 4-3-methyl-1,2,4-oxadiazol-5-yl-, methyl ester PubChem CID: 11096067 IUPAC Name: methyl 4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoate SMILES: CC1=NOC(=N1)C2=CC=C(C=C2)C(=O)OC

PubChem CID 11096067
CAS 209912-44-7
Molecular Weight (g/mol) 218.212
MDL Number MFCD08690288
SMILES CC1=NOC(=N1)C2=CC=C(C=C2)C(=O)OC
Synonym methyl 4-3-methyl-1,2,4-oxadiazol-5-yl benzoate,4-3-methyl-1,2,4-oxadiazole-5-yl benzoic acid methyl ester,benzoicacid, 4-3-methyl-1,2,4-oxadiazol-5-yl-, methyl ester
IUPAC Name methyl 4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoate
InChI Key PJYMNVKGDLTDJE-UHFFFAOYSA-N
Molecular Formula C11H10N2O3
15

Methyl non-2-ynoate, ≥95%, Maybridge™

CAS: 111-80-8 Molecular Formula: C10H16O2 Molecular Weight (g/mol): 168.236 MDL Number: MFCD00009547 InChI Key: NTLJTUMJJWVCTL-UHFFFAOYSA-N Synonym: methyl 2-nonynoate,2-nonynoic acid methyl ester,methyl octine carbonate,methyl octyne carbonate,2-nonynoic acid, methyl ester,methyloctyne carboxylate,methyloctyne carbonate,methyl octin carbonate,octynecarboxylic acid, methyl ester,methyl octynecarboxylate PubChem CID: 8137 ChEBI: CHEBI:51749 IUPAC Name: methyl non-2-ynoate SMILES: CCCCCCC#CC(=O)OC

PubChem CID 8137
CAS 111-80-8
Molecular Weight (g/mol) 168.236
ChEBI CHEBI:51749
MDL Number MFCD00009547
SMILES CCCCCCC#CC(=O)OC
Synonym methyl 2-nonynoate,2-nonynoic acid methyl ester,methyl octine carbonate,methyl octyne carbonate,2-nonynoic acid, methyl ester,methyloctyne carboxylate,methyloctyne carbonate,methyl octin carbonate,octynecarboxylic acid, methyl ester,methyl octynecarboxylate
IUPAC Name methyl non-2-ynoate
InChI Key NTLJTUMJJWVCTL-UHFFFAOYSA-N
Molecular Formula C10H16O2