Pyrazoles

Organic heterocyclic compounds that consists of a 5-membered ring of three carbon atoms and two adjacent nitrogen atoms with the formula: C₃H₃N₂H.

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6-Iodo-1H-indazole, 97%, Thermo Scientific™

CAS: 261953-36-0 Molecular Formula: C₇H₅IN₂ Molecular Weight (g/mol): 244.03 MDL Number: MFCD04114695 InChI Key: RSGAXJZKQDNFEP-UHFFFAOYSA-N Synonym: 6-iodoindazole,1h-indazole, 6-iodo,6-iodo 1h indazole,6-iodo-indazole,pubchem18081,indazole, 6-iodo PubChem CID: 12991241 IUPAC Name: 6-iodo-1H-indazole SMILES: C1=CC2=C(C=C1I)NN=C2

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Specifications

PubChem CID	12991241
CAS	261953-36-0
Molecular Weight (g/mol)	244.03
MDL Number	MFCD04114695
SMILES	C1=CC2=C(C=C1I)NN=C2
Synonym	6-iodoindazole,1h-indazole, 6-iodo,6-iodo 1h indazole,6-iodo-indazole,pubchem18081,indazole, 6-iodo
IUPAC Name	6-iodo-1H-indazole
InChI Key	RSGAXJZKQDNFEP-UHFFFAOYSA-N
Molecular Formula	C₇H₅IN₂

Thermo Scientific Chemicals Allopurinol, 98%

CAS: 315-30-0 Molecular Formula: C5H4N4O Molecular Weight (g/mol): 136.11 MDL Number: MFCD00599413 InChI Key: OFCNXPDARWKPPY-UHFFFAOYSA-N Synonym: allopurinol,1h-pyrazolo 3,4-d pyrimidin-4-ol,zyloprim,zyloric,lopurin,atisuril,bleminol,caplenal,uripurinol,embarin PubChem CID: 2094 ChEBI: CHEBI:40279 IUPAC Name: 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one SMILES: O=C1N=CN=C2NNC=C12

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Specifications

PubChem CID	2094
CAS	315-30-0
Molecular Weight (g/mol)	136.11
ChEBI	CHEBI:40279
MDL Number	MFCD00599413
SMILES	O=C1N=CN=C2NNC=C12
Synonym	allopurinol,1h-pyrazolo 3,4-d pyrimidin-4-ol,zyloprim,zyloric,lopurin,atisuril,bleminol,caplenal,uripurinol,embarin
IUPAC Name	1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one
InChI Key	OFCNXPDARWKPPY-UHFFFAOYSA-N
Molecular Formula	C5H4N4O

1-Methyl-1H-indazole-4-boronic acid pinacol ester, 97%, Thermo Scientific™

CAS: 885698-94-2 Molecular Formula: C14H19BN2O2 Molecular Weight (g/mol): 258.13 MDL Number: MFCD10700158 InChI Key: OZHFBNULPUBRJF-UHFFFAOYSA-N Synonym: 1-methyl-1h-indazole-4-boronic acid pinacol ester,1-methyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-indazole,1-methylindazole-4-boronic acid pinacol ester,1-methyl-4-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-indazole,1-methyl-1h-indazole-4-boronic acid, pinacol ester,1-methyl-4-tetramethyl-1,3,2-dioxaborolan-2-yl indazole,1-methyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl indazole,1-methyl-4-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-1h-indazole,1h-indazole, 1-methyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl PubChem CID: 45480187 IUPAC Name: 1-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole SMILES: CN1N=CC2=C(C=CC=C12)B1OC(C)(C)C(C)(C)O1

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Specifications

PubChem CID	45480187
CAS	885698-94-2
Molecular Weight (g/mol)	258.13
MDL Number	MFCD10700158
SMILES	CN1N=CC2=C(C=CC=C12)B1OC(C)(C)C(C)(C)O1
Synonym	1-methyl-1h-indazole-4-boronic acid pinacol ester,1-methyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-indazole,1-methylindazole-4-boronic acid pinacol ester,1-methyl-4-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-indazole,1-methyl-1h-indazole-4-boronic acid, pinacol ester,1-methyl-4-tetramethyl-1,3,2-dioxaborolan-2-yl indazole,1-methyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl indazole,1-methyl-4-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-1h-indazole,1h-indazole, 1-methyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl
IUPAC Name	1-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole
InChI Key	OZHFBNULPUBRJF-UHFFFAOYSA-N
Molecular Formula	C14H19BN2O2

3-Amino-4-chloro-1H-indazole, 97%

CAS: 20925-60-4 Molecular Formula: C7H6ClN3 Molecular Weight (g/mol): 167.596 MDL Number: MFCD00663139 InChI Key: QPLXQNVPEHUPTR-UHFFFAOYSA-N Synonym: 3-amino-4-chloro-1h-indazole,1h-indazol-3-amine, 4-chloro,3-amino-4-chloroindazole,4-chloro-1h-indazole-3-amine,4-chloro-1h-indazol-3-ylamine,3-amino4-chloroindazole,4-chloro-1h-indazole-3-ylamine PubChem CID: 313444 IUPAC Name: 4-chloro-1H-indazol-3-amine SMILES: C1=CC2=C(C(=C1)Cl)C(=NN2)N

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Specifications

PubChem CID	313444
CAS	20925-60-4
Molecular Weight (g/mol)	167.596
MDL Number	MFCD00663139
SMILES	C1=CC2=C(C(=C1)Cl)C(=NN2)N
Synonym	3-amino-4-chloro-1h-indazole,1h-indazol-3-amine, 4-chloro,3-amino-4-chloroindazole,4-chloro-1h-indazole-3-amine,4-chloro-1h-indazol-3-ylamine,3-amino4-chloroindazole,4-chloro-1h-indazole-3-ylamine
IUPAC Name	4-chloro-1H-indazol-3-amine
InChI Key	QPLXQNVPEHUPTR-UHFFFAOYSA-N
Molecular Formula	C7H6ClN3

1H-Indazole-6-carboxaldehyde, 97%

CAS: 669050-69-5 Molecular Formula: C₈H₆N₂O Molecular Weight (g/mol): 146.15 InChI Key: JTWYTTXTJFDYAG-UHFFFAOYSA-N Synonym: 1h-indazole-6-carboxaldehyde,6-formylindazole,6-formyl-1h-indazole,2h-indazole-6-carbaldehyde,indazole-6-carboxaldehyde,1h-indazole-6-cabaldehyde,pubchem23878,acmc-1bc45,2h-indazole-6-carboxaldehyde,1-h-indazole-6-carboxaldehyde PubChem CID: 18538368 IUPAC Name: 1H-indazole-6-carbaldehyde SMILES: C1=CC2=C(C=C1C=O)NN=C2

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Specifications

PubChem CID	18538368
CAS	669050-69-5
Molecular Weight (g/mol)	146.15
SMILES	C1=CC2=C(C=C1C=O)NN=C2
Synonym	1h-indazole-6-carboxaldehyde,6-formylindazole,6-formyl-1h-indazole,2h-indazole-6-carbaldehyde,indazole-6-carboxaldehyde,1h-indazole-6-cabaldehyde,pubchem23878,acmc-1bc45,2h-indazole-6-carboxaldehyde,1-h-indazole-6-carboxaldehyde
IUPAC Name	1H-indazole-6-carbaldehyde
InChI Key	JTWYTTXTJFDYAG-UHFFFAOYSA-N
Molecular Formula	C₈H₆N₂O

3-Amino-1H-indazole, 97%

CAS: 874-05-5 Molecular Formula: C7H7N3 Molecular Weight (g/mol): 133.154 MDL Number: MFCD00182045 InChI Key: YDTDKKULPWTHRV-UHFFFAOYSA-N Synonym: 3-amino-1h-indazole,1h-indazol-3-ylamine,3-aminoindazole,3-indazolamine,2h-indazol-3-amine,1h-indazole, 3-amino,aminoindazole,amino-indazole,1h-indazole-3-ylamine,indazole amine PubChem CID: 13399 IUPAC Name: 1H-indazol-3-amine SMILES: C1=CC=C2C(=C1)C(=NN2)N

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Specifications

PubChem CID	13399
CAS	874-05-5
Molecular Weight (g/mol)	133.154
MDL Number	MFCD00182045
SMILES	C1=CC=C2C(=C1)C(=NN2)N
Synonym	3-amino-1h-indazole,1h-indazol-3-ylamine,3-aminoindazole,3-indazolamine,2h-indazol-3-amine,1h-indazole, 3-amino,aminoindazole,amino-indazole,1h-indazole-3-ylamine,indazole amine
IUPAC Name	1H-indazol-3-amine
InChI Key	YDTDKKULPWTHRV-UHFFFAOYSA-N
Molecular Formula	C7H7N3

2-Methyl-2H-indazole-3-carbaldehyde, 97%, Thermo Scientific™

CAS: 34252-54-5 Molecular Formula: C9H8N2O Molecular Weight (g/mol): 160.18 MDL Number: MFCD00839530 InChI Key: SMWLSZQHLMZHHV-UHFFFAOYSA-N Synonym: 2-methyl-2h-indazole-3-carbaldehyde,2-methyl-3-formylindazole,2h-indazole-3-carboxaldehyde,2-methyl PubChem CID: 818117 IUPAC Name: 2-methylindazole-3-carbaldehyde SMILES: CN1N=C2C=CC=CC2=C1C=O

Pricing and Availability
Specifications

PubChem CID	818117
CAS	34252-54-5
Molecular Weight (g/mol)	160.18
MDL Number	MFCD00839530
SMILES	CN1N=C2C=CC=CC2=C1C=O
Synonym	2-methyl-2h-indazole-3-carbaldehyde,2-methyl-3-formylindazole,2h-indazole-3-carboxaldehyde,2-methyl
IUPAC Name	2-methylindazole-3-carbaldehyde
InChI Key	SMWLSZQHLMZHHV-UHFFFAOYSA-N
Molecular Formula	C9H8N2O

3-Amino-5-hydroxypyrazole, 98%

CAS: 6126-22-3 MDL Number: MFCD00022384 InChI Key: QZBGOTVBHYKUDS-UHFFFAOYSA-N Synonym: 3-amino-5-hydroxypyrazole,3-amino-1h-pyrazol-5-ol,5-amino-1h-pyrazol-3-ol,5-amino-1h-pyrazol-3 2h-one,3-amino-1,2-dihydropyrazol-5-one,5-aminopyrazol-3-ol,5-amino-2h-pyrazol-3-ol,3-pyrazolin-5-one, 3-amino,5-amino-2,3-dihydro-1h-pyrazol-3-one,1h-pyrazol-5-ol, 3-amino PubChem CID: 96221 IUPAC Name: 5-amino-1,2-dihydropyrazol-3-one SMILES: C1=C(NNC1=O)N

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Specifications

PubChem CID	96221
CAS	6126-22-3
MDL Number	MFCD00022384
SMILES	C1=C(NNC1=O)N
Synonym	3-amino-5-hydroxypyrazole,3-amino-1h-pyrazol-5-ol,5-amino-1h-pyrazol-3-ol,5-amino-1h-pyrazol-3 2h-one,3-amino-1,2-dihydropyrazol-5-one,5-aminopyrazol-3-ol,5-amino-2h-pyrazol-3-ol,3-pyrazolin-5-one, 3-amino,5-amino-2,3-dihydro-1h-pyrazol-3-one,1h-pyrazol-5-ol, 3-amino
IUPAC Name	5-amino-1,2-dihydropyrazol-3-one
InChI Key	QZBGOTVBHYKUDS-UHFFFAOYSA-N

1-Methyl-1H-pyrazole-4-boronic acid hydrochloride, 95%, Thermo Scientific™

CAS: 1026796-02-0 Molecular Formula: C4H8BClN2O2 Molecular Weight (g/mol): 162.38 MDL Number: MFCD09972098 InChI Key: YFPLZINTZVVVJM-UHFFFAOYSA-N Synonym: 1-methylpyrazole-4-boronic acid, hcl,1-methyl-1h-pyrazol-4-yl boronic acid hydrochloride,1-methyl-1h-pyrazole-4-boronic acid hydrochloride,1-methylpyrazole-4-boronic acid hcl,1-methyl-1h-pyrazol-4-ylboronic acid hydrochloride,1-methylpyrazol-4-ylboronic acid hydrochloride,1-methylpyrazole-4-boronic acid,hcl,1-methyl-1h-pyrazole-4-boronic acid xhcl,1-methylpyrazole-4-boronic acid hydrochloride,1-methyl-1h-pyrazole-4-boronic acid hcl PubChem CID: 45158882 IUPAC Name: (1-methylpyrazol-4-yl)boronic acid;hydrochloride SMILES: Cl.CN1C=C(C=N1)B(O)O

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Specifications

PubChem CID	45158882
CAS	1026796-02-0
Molecular Weight (g/mol)	162.38
MDL Number	MFCD09972098
SMILES	Cl.CN1C=C(C=N1)B(O)O
Synonym	1-methylpyrazole-4-boronic acid, hcl,1-methyl-1h-pyrazol-4-yl boronic acid hydrochloride,1-methyl-1h-pyrazole-4-boronic acid hydrochloride,1-methylpyrazole-4-boronic acid hcl,1-methyl-1h-pyrazol-4-ylboronic acid hydrochloride,1-methylpyrazol-4-ylboronic acid hydrochloride,1-methylpyrazole-4-boronic acid,hcl,1-methyl-1h-pyrazole-4-boronic acid xhcl,1-methylpyrazole-4-boronic acid hydrochloride,1-methyl-1h-pyrazole-4-boronic acid hcl
IUPAC Name	(1-methylpyrazol-4-yl)boronic acid;hydrochloride
InChI Key	YFPLZINTZVVVJM-UHFFFAOYSA-N
Molecular Formula	C4H8BClN2O2

3-Amino-1H-pyrazole, 97+%

CAS: 1820-80-0 Molecular Formula: C3H5N3 Molecular Weight (g/mol): 83.094 MDL Number: MFCD00005236 InChI Key: JVVRJMXHNUAPHW-UHFFFAOYSA-N Synonym: 3-aminopyrazole,1h-pyrazol-3-amine,1h-pyrazole-5-amine,5-aminopyrazole,1h-pyrazol-3-ylamine,3-amino-1h-pyrazole,3-aminopyrozole,5-amino-1h-pyrazole,aminopyrazole,3-pyrazolamine PubChem CID: 74561 IUPAC Name: 1H-pyrazol-5-amine SMILES: C1=C(NN=C1)N

Pricing and Availability
Specifications

PubChem CID	74561
CAS	1820-80-0
Molecular Weight (g/mol)	83.094
MDL Number	MFCD00005236
SMILES	C1=C(NN=C1)N
Synonym	3-aminopyrazole,1h-pyrazol-3-amine,1h-pyrazole-5-amine,5-aminopyrazole,1h-pyrazol-3-ylamine,3-amino-1h-pyrazole,3-aminopyrozole,5-amino-1h-pyrazole,aminopyrazole,3-pyrazolamine
IUPAC Name	1H-pyrazol-5-amine
InChI Key	JVVRJMXHNUAPHW-UHFFFAOYSA-N
Molecular Formula	C3H5N3

Methyl 4-(1H-pyrazol-1-ylmethyl)benzoate, 97%, Thermo Scientific™

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4-Amino-1-methyl-1H-pyrazole, 95%

CAS: 69843-13-6 Molecular Formula: C4H7N3 Molecular Weight (g/mol): 97.121 MDL Number: MFCD05667135 InChI Key: LBGSWBJURUFGLR-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazol-4-amine,1-methyl-1h-pyrazol-4-ylamine,4-amino-1-methylpyrazole,1h-pyrazol-4-amine, 1-methyl,1-methyl-1h-pyrazole-4-ylamine,4-amino-1-methyl-1h-pyrazole,1-methylpyrazole-4-ylamine,acmc-20a0x1,4-amino-1-methyl-pyrazole,1-methyl-1h-pyrazole-4-amine PubChem CID: 4770990 IUPAC Name: 1-methylpyrazol-4-amine SMILES: CN1C=C(C=N1)N

Pricing and Availability
Specifications

PubChem CID	4770990
CAS	69843-13-6
Molecular Weight (g/mol)	97.121
MDL Number	MFCD05667135
SMILES	CN1C=C(C=N1)N
Synonym	1-methyl-1h-pyrazol-4-amine,1-methyl-1h-pyrazol-4-ylamine,4-amino-1-methylpyrazole,1h-pyrazol-4-amine, 1-methyl,1-methyl-1h-pyrazole-4-ylamine,4-amino-1-methyl-1h-pyrazole,1-methylpyrazole-4-ylamine,acmc-20a0x1,4-amino-1-methyl-pyrazole,1-methyl-1h-pyrazole-4-amine
IUPAC Name	1-methylpyrazol-4-amine
InChI Key	LBGSWBJURUFGLR-UHFFFAOYSA-N
Molecular Formula	C4H7N3

3-Aminopyrazole, 98%

CAS: 1820-80-0 Molecular Formula: C₃H₅N₃ Molecular Weight (g/mol): 83.09 MDL Number: MFCD00005236 InChI Key: JVVRJMXHNUAPHW-UHFFFAOYSA-N Synonym: 3-aminopyrazole,1h-pyrazol-3-amine,1h-pyrazole-5-amine,5-aminopyrazole,1h-pyrazol-3-ylamine,3-amino-1h-pyrazole,3-aminopyrozole,5-amino-1h-pyrazole,aminopyrazole,3-pyrazolamine PubChem CID: 74561 IUPAC Name: 1H-pyrazol-5-amine SMILES: C1=C(NN=C1)N

Pricing and Availability
Specifications

PubChem CID	74561
CAS	1820-80-0
Molecular Weight (g/mol)	83.09
MDL Number	MFCD00005236
SMILES	C1=C(NN=C1)N
Synonym	3-aminopyrazole,1h-pyrazol-3-amine,1h-pyrazole-5-amine,5-aminopyrazole,1h-pyrazol-3-ylamine,3-amino-1h-pyrazole,3-aminopyrozole,5-amino-1h-pyrazole,aminopyrazole,3-pyrazolamine
IUPAC Name	1H-pyrazol-5-amine
InChI Key	JVVRJMXHNUAPHW-UHFFFAOYSA-N
Molecular Formula	C₃H₅N₃

4-(Trifluoromethyl)-1H-indazole, 97%, Thermo Scientific™

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4-(2-Bromoethyl)-3,5-dimethyl-1H-pyrazole, 97%, Thermo Scientific™

CAS: 83467-28-1 Molecular Formula: C7H11BrN2 Molecular Weight (g/mol): 203.08 MDL Number: MFCD00480987 InChI Key: HGGLMDBNLJUEKA-UHFFFAOYSA-N Synonym: 4-2-bromoethyl-3,5-dimethyl-1h-pyrazole,4-2-bromo-ethyl-3,5-dimethyl-1h-pyrazole,3,5-dimethyl-4-2-bromoethyl-1h-pyrazole,4-2-bromoethyl-3,5-dimethyl-1h-pyrazol,1h-pyrazole, 4-2-bromoethyl-3,5-dimethyl,4-2-bromoethyl-3,5-dimethylpyrazole,akos pao-0750,pubchem12761,timtec-bb sbb010155,aronis23735 PubChem CID: 572879 IUPAC Name: 4-(2-bromoethyl)-3,5-dimethyl-1H-pyrazole SMILES: CC1=C(CCBr)C(C)=NN1

Pricing and Availability
Specifications

PubChem CID	572879
CAS	83467-28-1
Molecular Weight (g/mol)	203.08
MDL Number	MFCD00480987
SMILES	CC1=C(CCBr)C(C)=NN1
Synonym	4-2-bromoethyl-3,5-dimethyl-1h-pyrazole,4-2-bromo-ethyl-3,5-dimethyl-1h-pyrazole,3,5-dimethyl-4-2-bromoethyl-1h-pyrazole,4-2-bromoethyl-3,5-dimethyl-1h-pyrazol,1h-pyrazole, 4-2-bromoethyl-3,5-dimethyl,4-2-bromoethyl-3,5-dimethylpyrazole,akos pao-0750,pubchem12761,timtec-bb sbb010155,aronis23735
IUPAC Name	4-(2-bromoethyl)-3,5-dimethyl-1H-pyrazole
InChI Key	HGGLMDBNLJUEKA-UHFFFAOYSA-N
Molecular Formula	C7H11BrN2

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