AG22691
500-72-1 | Anilino(oxo)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AG22691
ChemicalName
Anilino(oxo)acetic acid
CasNumber
500-72-1
MolecularFormula
C8H7NO3
MolecularWeight
165.1461
MdlNumber
MFCD00020384
Smiles
O=C(C(=O)O)Nc1ccccc1
NscNumber
47546
Complexity
185
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
0.8
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CatalogNumber: AG22691
ChemicalName: Anilino(oxo)acetic acid
CasNumber: 500-72-1
MolecularFormula: C8H7NO3
MolecularWeight: 165.1461
MdlNumber: MFCD00020384
Smiles: O=C(C(=O)O)Nc1ccccc1
NscNumber: 47546
Complexity: 185
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 0.8
CatalogNumber:
AG22691
ChemicalName:
Anilino(oxo)acetic acid
CasNumber:
500-72-1
MolecularFormula:
C8H7NO3
MolecularWeight:
165.1461
MdlNumber:
MFCD00020384
Smiles:
O=C(C(=O)O)Nc1ccccc1
NscNumber:
47546
Complexity:
185
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
0.8
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Smiles: COc1ccccc1C=CC(=O)c1ccccc1
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Complexity: __
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HeavyAtomCount: __
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HydrogenBondDonorCount: __
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Xlogp3: __
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Smiles:
COc1ccccc1C=CC(=O)c1ccccc1
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HeavyAtomCount:
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RotatableBondCount:
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Smiles: Cc1ccc2c(c1)c(=O)c(cn2C)C(=O)O
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Smiles:
Cc1ccc2c(c1)c(=O)c(cn2C)C(=O)O
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Smiles: Clc1ccc(cc1)C(=O)Nc1cn(c(c1)C(=O)O)C
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CasNumber:
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MolecularFormula:
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Smiles:
Clc1ccc(cc1)C(=O)Nc1cn(c(c1)C(=O)O)C
NscNumber:
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Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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