AB68012
82231-51-4 | 4-Methylpyrazole-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB68012
ChemicalName
4-Methylpyrazole-3-carboxylic acid
CasNumber
82231-51-4
MolecularFormula
C5H6N2O2
MolecularWeight
126.1133
MdlNumber
MFCD16495896
Smiles
Cc1c[nH]nc1C(=O)O
Complexity
126
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
0.4
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CatalogNumber: AB68012
ChemicalName: 4-Methylpyrazole-3-carboxylic acid
CasNumber: 82231-51-4
MolecularFormula: C5H6N2O2
MolecularWeight: 126.1133
MdlNumber: MFCD16495896
Smiles: Cc1c[nH]nc1C(=O)O
Complexity: 126
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 0.4
CatalogNumber:
AB68012
ChemicalName:
4-Methylpyrazole-3-carboxylic acid
CasNumber:
82231-51-4
MolecularFormula:
C5H6N2O2
MolecularWeight:
126.1133
MdlNumber:
MFCD16495896
Smiles:
Cc1c[nH]nc1C(=O)O
Complexity:
126
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
0.4
CatalogNumber: AB68013
ChemicalName: 2-Formyl-4-picoline
CasNumber: 53547-60-7
MolecularFormula: C7H7NO
MolecularWeight: 121.1366
MdlNumber: MFCD07367933
Smiles: Cc1cc(C=O)ncc1
Complexity: 103
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 0.7
CatalogNumber:
AB68013
ChemicalName:
2-Formyl-4-picoline
CasNumber:
53547-60-7
MolecularFormula:
C7H7NO
MolecularWeight:
121.1366
MdlNumber:
MFCD07367933
Smiles:
Cc1cc(C=O)ncc1
Complexity:
103
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
0.7
CatalogNumber: AB68014
ChemicalName: 4-Methylpyridine-3-carboxylic acid
CasNumber: 3222-50-2
MolecularFormula: C7H7NO2
MolecularWeight: 137.136
MdlNumber: MFCD00128869
Smiles: OC(=O)c1cnccc1C
Complexity: 136
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.7
CatalogNumber:
AB68014
ChemicalName:
4-Methylpyridine-3-carboxylic acid
CasNumber:
3222-50-2
MolecularFormula:
C7H7NO2
MolecularWeight:
137.136
MdlNumber:
MFCD00128869
Smiles:
OC(=O)c1cnccc1C
Complexity:
136
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccncn1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccncn1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__