AI59508
887244-17-9 | 4-(3-Fluorophenyl)-2-nitrobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AI59508
ChemicalName
4-(3-Fluorophenyl)-2-nitrobenzoic acid
CasNumber
887244-17-9
MolecularFormula
C13H8FNO4
MolecularWeight
261.2053
MdlNumber
MFCD14700015
Smiles
Fc1cccc(c1)c1ccc(c(c1)[N+](=O)[O-])C(=O)O
Complexity
357
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3
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CatalogNumber: AI59508
ChemicalName: 4-(3-Fluorophenyl)-2-nitrobenzoic acid
CasNumber: 887244-17-9
MolecularFormula: C13H8FNO4
MolecularWeight: 261.2053
MdlNumber: MFCD14700015
Smiles: Fc1cccc(c1)c1ccc(c(c1)[N+](=O)[O-])C(=O)O
Complexity: 357
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3
CatalogNumber:
AI59508
ChemicalName:
4-(3-Fluorophenyl)-2-nitrobenzoic acid
CasNumber:
887244-17-9
MolecularFormula:
C13H8FNO4
MolecularWeight:
261.2053
MdlNumber:
MFCD14700015
Smiles:
Fc1cccc(c1)c1ccc(c(c1)[N+](=O)[O-])C(=O)O
Complexity:
357
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3
CatalogNumber: __
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MolecularFormula: __
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Smiles: COC1=CC=CC=C1C2=CC(=C(C=C2)C(=O)O)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularWeight:
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Smiles:
COC1=CC=CC=C1C2=CC(=C(C=C2)C(=O)O)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1=CC(=C(C=C1C2=CC(=CC(=C2)F)F)[N+](=O)[O-])C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
C1=CC(=C(C=C1C2=CC(=CC(=C2)F)F)[N+](=O)[O-])C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Ic1ccc(cc1)Oc1ccc(cc1C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Ic1ccc(cc1)Oc1ccc(cc1C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__