AE05288
775545-30-7 | 3-Pyridinecarboxylic acid, 6-(hydroxymethyl)-
Manufacturer: A2B Chem
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CatalogNumber
AE05288
ChemicalName
3-Pyridinecarboxylic acid, 6-(hydroxymethyl)-
CasNumber
775545-30-7
MolecularFormula
C7H7NO3
MolecularWeight
153.13537999999997
MdlNumber
MFCD11977430
Smiles
OCc1ccc(cn1)C(=O)O
Complexity
149
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
-0.5
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CatalogNumber: AE05288
ChemicalName: 3-Pyridinecarboxylic acid, 6-(hydroxymethyl)-
CasNumber: 775545-30-7
MolecularFormula: C7H7NO3
MolecularWeight: 153.13537999999997
MdlNumber: MFCD11977430
Smiles: OCc1ccc(cn1)C(=O)O
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: -0.5
CatalogNumber:
AE05288
ChemicalName:
3-Pyridinecarboxylic acid, 6-(hydroxymethyl)-
CasNumber:
775545-30-7
MolecularFormula:
C7H7NO3
MolecularWeight:
153.13537999999997
MdlNumber:
MFCD11977430
Smiles:
OCc1ccc(cn1)C(=O)O
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
-0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1c(Cl)cnn(c1=O)Cc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
COc1c(Cl)cnn(c1=O)Cc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@H](CCC(=O)O)NCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
OC(=O)[C@H](CCC(=O)O)NCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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ChemicalName: __
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MolecularFormula: __
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Smiles: CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(CO)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(CO)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__