AG32448
556651-33-3 | 4-Amino-3-bromo-5-nitrobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AG32448
ChemicalName
4-Amino-3-bromo-5-nitrobenzoic acid
CasNumber
556651-33-3
MolecularFormula
C7H5BrN2O4
MolecularWeight
261.0296
MdlNumber
MFCD00507339
Smiles
[O-][N+](=O)c1cc(cc(c1N)Br)C(=O)O
Complexity
255
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
1.8
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CatalogNumber: AG32448
ChemicalName: 4-Amino-3-bromo-5-nitrobenzoic acid
CasNumber: 556651-33-3
MolecularFormula: C7H5BrN2O4
MolecularWeight: 261.0296
MdlNumber: MFCD00507339
Smiles: [O-][N+](=O)c1cc(cc(c1N)Br)C(=O)O
Complexity: 255
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AG32448
ChemicalName:
4-Amino-3-bromo-5-nitrobenzoic acid
CasNumber:
556651-33-3
MolecularFormula:
C7H5BrN2O4
MolecularWeight:
261.0296
MdlNumber:
MFCD00507339
Smiles:
[O-][N+](=O)c1cc(cc(c1N)Br)C(=O)O
Complexity:
255
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(N)c(cc1Cl)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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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:
COc1cc(N)c(cc1Cl)[N+](=O)[O-]
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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MolecularFormula: __
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Smiles: Brc1ccc2c(c1)c(C(=O)O)c(cn2)O
Complexity: __
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Smiles:
Brc1ccc2c(c1)c(C(=O)O)c(cn2)O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: Nc1[nH]nc2c1CCCC2
Complexity: __
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ChemicalName:
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MolecularFormula:
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MolecularWeight:
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Smiles:
Nc1[nH]nc2c1CCCC2
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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