Pyrazoles

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

1 – 15 of 203 results

Bendazac, Thermo Scientific Chemicals

CAS: 20187-55-7 Molecular Formula: C16H13N2NaO3 Molecular Weight (g/mol): 304.28 InChI Key: GHFGHIKJGVMEFT-UHFFFAOYSA-M IUPAC Name: sodium 2-[(1-benzyl-1H-indazol-3-yl)oxy]acetate SMILES: [Na+].[O-]C(=O)COC1=NN(CC2=CC=CC=C2)C2=CC=CC=C12

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Specifications

CAS	20187-55-7
Molecular Weight (g/mol)	304.28
SMILES	[Na+].[O-]C(=O)COC1=NN(CC2=CC=CC=C2)C2=CC=CC=C12
IUPAC Name	sodium 2-[(1-benzyl-1H-indazol-3-yl)oxy]acetate
InChI Key	GHFGHIKJGVMEFT-UHFFFAOYSA-M
Molecular Formula	C16H13N2NaO3

5-Nitro-1H-pyrazole, 90%, Thermo Scientific™

CAS: 26621-44-3 Molecular Formula: C3H3N3O2 Molecular Weight (g/mol): 113.08 MDL Number: MFCD00159621,MFCD00238787 InChI Key: MZRUFMBFIKGOAL-UHFFFAOYSA-N Synonym: 3-nitro-1h-pyrazole,3-nitropyrazole,1h-pyrazole, 3-nitro,3-nitro-2h-pyrazole,nitropyrazole,pyrazole, 3-nitro,5-nitro-1h-pyrazol,djw 94,djw-94,5-nitropyrazole PubChem CID: 123419 IUPAC Name: 5-nitro-1H-pyrazole SMILES: [O-][N+](=O)C1=CC=NN1

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Specifications

PubChem CID	123419
CAS	26621-44-3
Molecular Weight (g/mol)	113.08
MDL Number	MFCD00159621,MFCD00238787
SMILES	[O-][N+](=O)C1=CC=NN1
Synonym	3-nitro-1h-pyrazole,3-nitropyrazole,1h-pyrazole, 3-nitro,3-nitro-2h-pyrazole,nitropyrazole,pyrazole, 3-nitro,5-nitro-1h-pyrazol,djw 94,djw-94,5-nitropyrazole
IUPAC Name	5-nitro-1H-pyrazole
InChI Key	MZRUFMBFIKGOAL-UHFFFAOYSA-N
Molecular Formula	C3H3N3O2

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

3-Nitro-1H-pyrazole, 97%, Thermo Scientific Chemicals

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Specifications

PubChem CID	123419
CAS	26621-44-3
Molecular Weight (g/mol)	113.08
MDL Number	MFCD00159621,MFCD00238787
SMILES	[O-][N+](=O)C1=CC=NN1
Synonym	3-nitro-1h-pyrazole,3-nitropyrazole,1h-pyrazole, 3-nitro,3-nitro-2h-pyrazole,nitropyrazole,pyrazole, 3-nitro,5-nitro-1h-pyrazol,djw 94,djw-94,5-nitropyrazole
IUPAC Name	5-nitro-1H-pyrazole
InChI Key	MZRUFMBFIKGOAL-UHFFFAOYSA-N
Molecular Formula	C3H3N3O2

1H-Indazole-4-carboxylic acid, 97%, Thermo Scientific™

CAS: 677306-38-6 Molecular Formula: C₈H₆N₂O₂ Molecular Weight (g/mol): 162.15 MDL Number: MFCD03840644 InChI Key: KGKZHHIUOZGUNP-UHFFFAOYSA-N Synonym: indazole-4-carboxylic acid,1h-indazole-4-carboxylicacid,4-indazolecarboxylic acid,4-carboxy-1h-indazole,2h-indazole-4-carboxylic acid,pubchem19651,acmc-1b3os,ksc352q1d,1h-indazole-4-carboxylic acid,4-1h indazole carboxylic acid PubChem CID: 21982323 IUPAC Name: 1H-indazole-4-carboxylic acid SMILES: C1=CC(=C2C=NNC2=C1)C(=O)O

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Specifications

PubChem CID	21982323
CAS	677306-38-6
Molecular Weight (g/mol)	162.15
MDL Number	MFCD03840644
SMILES	C1=CC(=C2C=NNC2=C1)C(=O)O
Synonym	indazole-4-carboxylic acid,1h-indazole-4-carboxylicacid,4-indazolecarboxylic acid,4-carboxy-1h-indazole,2h-indazole-4-carboxylic acid,pubchem19651,acmc-1b3os,ksc352q1d,1h-indazole-4-carboxylic acid,4-1h indazole carboxylic acid
IUPAC Name	1H-indazole-4-carboxylic acid
InChI Key	KGKZHHIUOZGUNP-UHFFFAOYSA-N
Molecular Formula	C₈H₆N₂O₂

1H-Indazole-7-carboxylic acid, 97%, Thermo Scientific Chemicals

CAS: 677304-69-7 Molecular Formula: C₈H₆N₂O₂ Molecular Weight (g/mol): 162.15 MDL Number: MFCD06804572 InChI Key: WBCWIQCXHSXMDH-UHFFFAOYSA-N Synonym: 7-carboxy-1h-indazole,1h-indazole-7-carboxylicacid,indazole-7-carboxylic acid,7-indazole carboxylic acid,pubchem17673,acmc-1bl1h,ksc351o8t,2h-indazole-7-carboxylic acid,7-1h indazole carboxylic acid PubChem CID: 12639205 IUPAC Name: 1H-indazole-7-carboxylic acid SMILES: C1=CC2=C(C(=C1)C(=O)O)NN=C2

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Specifications

PubChem CID	12639205
CAS	677304-69-7
Molecular Weight (g/mol)	162.15
MDL Number	MFCD06804572
SMILES	C1=CC2=C(C(=C1)C(=O)O)NN=C2
Synonym	7-carboxy-1h-indazole,1h-indazole-7-carboxylicacid,indazole-7-carboxylic acid,7-indazole carboxylic acid,pubchem17673,acmc-1bl1h,ksc351o8t,2h-indazole-7-carboxylic acid,7-1h indazole carboxylic acid
IUPAC Name	1H-indazole-7-carboxylic acid
InChI Key	WBCWIQCXHSXMDH-UHFFFAOYSA-N
Molecular Formula	C₈H₆N₂O₂

1H-Indazol-6-ylboronic acid, 97%, Thermo Scientific Chemicals

CAS: 885068-10-0 Molecular Formula: C7H7BN2O2 Molecular Weight (g/mol): 161.96 MDL Number: MFCD04972419 InChI Key: ZKNLCHWRWRYPGG-UHFFFAOYSA-N Synonym: 6-indazolyboronic acid,1h-indazol-6-yl-6-boronic acid,1h-indazole-6-boronic acid,indazole-6-boronic acid,1h-indazol-6-yl boronic acid,6-indazolboronic acid,boronic acid, 1h-indazol-6-yl,1h-indazole-6-boronicacid,6-indazoleboronicacid,zlchem 1076 PubChem CID: 24728617 IUPAC Name: 1H-indazol-6-ylboronic acid SMILES: OB(O)C1=CC=C2C=NNC2=C1

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Specifications

PubChem CID	24728617
CAS	885068-10-0
Molecular Weight (g/mol)	161.96
MDL Number	MFCD04972419
SMILES	OB(O)C1=CC=C2C=NNC2=C1
Synonym	6-indazolyboronic acid,1h-indazol-6-yl-6-boronic acid,1h-indazole-6-boronic acid,indazole-6-boronic acid,1h-indazol-6-yl boronic acid,6-indazolboronic acid,boronic acid, 1h-indazol-6-yl,1h-indazole-6-boronicacid,6-indazoleboronicacid,zlchem 1076
IUPAC Name	1H-indazol-6-ylboronic acid
InChI Key	ZKNLCHWRWRYPGG-UHFFFAOYSA-N
Molecular Formula	C7H7BN2O2

Methyl 1H-indazole-6-carboxylate, 95%, Thermo Scientific™

CAS: 170487-40-8 Molecular Formula: C9H8N2O2 Molecular Weight (g/mol): 176.175 MDL Number: MFCD07371612 InChI Key: TUSICEWIXLMXEY-UHFFFAOYSA-N Synonym: 1h-indazole-6-carboxylic acid methyl ester,methyl indazole-6-carboxylate,indazole-6-carboxylic acid methyl ester,6-1h indazole carboxylic acid methyl ester,1h-indazole-6-carboxylic acid, methyl ester,pubchem18064,methyl indazole-6carboxylate,ksc494o4p,methyl-1h-indazole-6-carboxylate,2h-indazole-6-carboxylic acid methyl ester PubChem CID: 286535 IUPAC Name: methyl 1H-indazole-6-carboxylate SMILES: COC(=O)C1=CC2=C(C=C1)C=NN2

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Specifications

PubChem CID	286535
CAS	170487-40-8
Molecular Weight (g/mol)	176.175
MDL Number	MFCD07371612
SMILES	COC(=O)C1=CC2=C(C=C1)C=NN2
Synonym	1h-indazole-6-carboxylic acid methyl ester,methyl indazole-6-carboxylate,indazole-6-carboxylic acid methyl ester,6-1h indazole carboxylic acid methyl ester,1h-indazole-6-carboxylic acid, methyl ester,pubchem18064,methyl indazole-6carboxylate,ksc494o4p,methyl-1h-indazole-6-carboxylate,2h-indazole-6-carboxylic acid methyl ester
IUPAC Name	methyl 1H-indazole-6-carboxylate
InChI Key	TUSICEWIXLMXEY-UHFFFAOYSA-N
Molecular Formula	C9H8N2O2

4-(1H-Pyrazol-1-ylmethyl)aniline, 95%, Thermo Scientific™

CAS: 142335-61-3 Molecular Formula: C10H11N3 Molecular Weight (g/mol): 173.22 MDL Number: MFCD03422514 InChI Key: ISRYTHBRUSOVAB-UHFFFAOYSA-N Synonym: 4-1h-pyrazol-1-ylmethyl aniline,4-1h-pyrazol-1-yl methyl aniline,4-pyrazol-1-ylmethyl aniline,4-1-pyrazolyl methyl aniline,4-pyrazol-1-ylmethyl-phenylamine,4-pyrazol-1-ylmethylphenylamine,benzenamine,4-1h-pyrazol-1-ylmethyl,4-pyrazolylmethyl phenylamine,pyrazolylmethylaniline PubChem CID: 2764412 IUPAC Name: 4-(pyrazol-1-ylmethyl)aniline SMILES: NC1=CC=C(CN2C=CC=N2)C=C1

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Specifications

PubChem CID	2764412
CAS	142335-61-3
Molecular Weight (g/mol)	173.22
MDL Number	MFCD03422514
SMILES	NC1=CC=C(CN2C=CC=N2)C=C1
Synonym	4-1h-pyrazol-1-ylmethyl aniline,4-1h-pyrazol-1-yl methyl aniline,4-pyrazol-1-ylmethyl aniline,4-1-pyrazolyl methyl aniline,4-pyrazol-1-ylmethyl-phenylamine,4-pyrazol-1-ylmethylphenylamine,benzenamine,4-1h-pyrazol-1-ylmethyl,4-pyrazolylmethyl phenylamine,pyrazolylmethylaniline
IUPAC Name	4-(pyrazol-1-ylmethyl)aniline
InChI Key	ISRYTHBRUSOVAB-UHFFFAOYSA-N
Molecular Formula	C10H11N3

1-Methyl-1H-pyrazol-5-ylamine, 97%, Thermo Scientific™

CAS: 1192-21-8 Molecular Formula: C4H7N3 Molecular Weight (g/mol): 97.121 MDL Number: MFCD00068156 InChI Key: JESRNIJXVIFVOV-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazol-5-amine,1-methyl-1h-pyrazol-5-ylamine,1-methyl-5-aminopyrazole,5-amino-1-methylpyrazole,5-amino-1-methyl-1h-pyrazole,1h-pyrazol-5-amine, 1-methyl,2-methyl-2h-pyrazol-3-ylamine,5-amino-1-methyl-pyrazole,2-methyl-2h-pyrazol-3-amine,1-methylpyrazole-5-ylamine PubChem CID: 136927 IUPAC Name: 2-methylpyrazol-3-amine SMILES: CN1C(=CC=N1)N

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Specifications

PubChem CID	136927
CAS	1192-21-8
Molecular Weight (g/mol)	97.121
MDL Number	MFCD00068156
SMILES	CN1C(=CC=N1)N
Synonym	1-methyl-1h-pyrazol-5-amine,1-methyl-1h-pyrazol-5-ylamine,1-methyl-5-aminopyrazole,5-amino-1-methylpyrazole,5-amino-1-methyl-1h-pyrazole,1h-pyrazol-5-amine, 1-methyl,2-methyl-2h-pyrazol-3-ylamine,5-amino-1-methyl-pyrazole,2-methyl-2h-pyrazol-3-amine,1-methylpyrazole-5-ylamine
IUPAC Name	2-methylpyrazol-3-amine
InChI Key	JESRNIJXVIFVOV-UHFFFAOYSA-N
Molecular Formula	C4H7N3

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

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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

1-Methyl-1H-indazole-3-carbaldehyde, 97%, Thermo Scientific™

CAS: 4002-83-9 Molecular Formula: C9H8N2O Molecular Weight (g/mol): 160.18 MDL Number: MFCD08060478 InChI Key: KYDLGYCLCFKUHY-UHFFFAOYSA-N Synonym: 1-methyl-1h-indazole-3-carbaldehyde,1-methyl-1h-indazole-3-carboxaldehyde,3-formyl-1-methyl-1h-indazole,1-methyl-3-formylindazole,1h-indazole-3-carboxaldehyde,1-methyl PubChem CID: 7164545 IUPAC Name: 1-methylindazole-3-carbaldehyde SMILES: CN1N=C(C=O)C2=CC=CC=C12

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Specifications

PubChem CID	7164545
CAS	4002-83-9
Molecular Weight (g/mol)	160.18
MDL Number	MFCD08060478
SMILES	CN1N=C(C=O)C2=CC=CC=C12
Synonym	1-methyl-1h-indazole-3-carbaldehyde,1-methyl-1h-indazole-3-carboxaldehyde,3-formyl-1-methyl-1h-indazole,1-methyl-3-formylindazole,1h-indazole-3-carboxaldehyde,1-methyl
IUPAC Name	1-methylindazole-3-carbaldehyde
InChI Key	KYDLGYCLCFKUHY-UHFFFAOYSA-N
Molecular Formula	C9H8N2O

1,3-Dimethyl-1H-pyrazol-5-amine, 97%, Thermo Scientific™

CAS: 3524-32-1 Molecular Formula: C5H9N3 Molecular Weight (g/mol): 111.148 MDL Number: MFCD00051651 InChI Key: ZFDGMMZLXSFNFU-UHFFFAOYSA-N Synonym: 5-amino-1,3-dimethylpyrazole,1,3-dimethyl-1h-pyrazol-5-amine,1,3-dimethyl-1h-pyrazole-5yl-amine,1h-pyrazol-5-amine, 1,3-dimethyl,3-amino-2,5-dimethyl-2h-pyrazole,2,5-dimethyl-2h-pyrazol-3-ylamine,5-amino-1,3-dimethyl pyrazole,1,3-dimethyl-1h-pyrazole-5-amine,5-amino-1,3-dimethyl-1h-pyrazole,1,3-dimethyl-5-aminopyrazole PubChem CID: 520721 IUPAC Name: 2,5-dimethylpyrazol-3-amine SMILES: CC1=NN(C(=C1)N)C

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Specifications

PubChem CID	520721
CAS	3524-32-1
Molecular Weight (g/mol)	111.148
MDL Number	MFCD00051651
SMILES	CC1=NN(C(=C1)N)C
Synonym	5-amino-1,3-dimethylpyrazole,1,3-dimethyl-1h-pyrazol-5-amine,1,3-dimethyl-1h-pyrazole-5yl-amine,1h-pyrazol-5-amine, 1,3-dimethyl,3-amino-2,5-dimethyl-2h-pyrazole,2,5-dimethyl-2h-pyrazol-3-ylamine,5-amino-1,3-dimethyl pyrazole,1,3-dimethyl-1h-pyrazole-5-amine,5-amino-1,3-dimethyl-1h-pyrazole,1,3-dimethyl-5-aminopyrazole
IUPAC Name	2,5-dimethylpyrazol-3-amine
InChI Key	ZFDGMMZLXSFNFU-UHFFFAOYSA-N
Molecular Formula	C5H9N3

5-(Chloromethyl)-1,3-dimethyl-1h-pyrazole, 97%, Thermo Scientific™

CAS: 852227-86-2 Molecular Formula: C6H9ClN2 Molecular Weight (g/mol): 144.60 MDL Number: MFCD07368502 InChI Key: SGEZKPNUNBVVLB-UHFFFAOYSA-N PubChem CID: 4961270 SMILES: CN1N=C(C)C=C1CCl

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Specifications

PubChem CID	4961270
CAS	852227-86-2
Molecular Weight (g/mol)	144.60
MDL Number	MFCD07368502
SMILES	CN1N=C(C)C=C1CCl
InChI Key	SGEZKPNUNBVVLB-UHFFFAOYSA-N
Molecular Formula	C6H9ClN2

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

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Pyrazoles

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