AF46177
2011-09-8 | 4,5-Dichloro-2-nitrobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AF46177
ChemicalName
4,5-Dichloro-2-nitrobenzoic acid
CasNumber
2011-09-8
MolecularFormula
C7H3Cl2NO4
MolecularWeight
236.009
MdlNumber
MFCD17015364
Smiles
OC(=O)c1cc(Cl)c(cc1[N+](=O)[O-])Cl
Complexity
255
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.7
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CatalogNumber: AF46177
ChemicalName: 4,5-Dichloro-2-nitrobenzoic acid
CasNumber: 2011-09-8
MolecularFormula: C7H3Cl2NO4
MolecularWeight: 236.009
MdlNumber: MFCD17015364
Smiles: OC(=O)c1cc(Cl)c(cc1[N+](=O)[O-])Cl
Complexity: 255
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.7
CatalogNumber:
AF46177
ChemicalName:
4,5-Dichloro-2-nitrobenzoic acid
CasNumber:
2011-09-8
MolecularFormula:
C7H3Cl2NO4
MolecularWeight:
236.009
MdlNumber:
MFCD17015364
Smiles:
OC(=O)c1cc(Cl)c(cc1[N+](=O)[O-])Cl
Complexity:
255
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ccc(cc1c1cc(Cl)ccc1N)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
Nc1ccc(cc1c1cc(Cl)ccc1N)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCC=CCC(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCCCCC=CCC(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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MdlNumber: __
Smiles: CC1C2CCCCC2OP(=S)(O1)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC1C2CCCCC2OP(=S)(O1)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__