AA87192
160877-40-7 | 3-(4-Fluoro-3-nitrophenyl)propanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA87192
ChemicalName
3-(4-Fluoro-3-nitrophenyl)propanoic acid
CasNumber
160877-40-7
MolecularFormula
C9H8FNO4
MolecularWeight
213.1625
MdlNumber
MFCD25959676
Smiles
OC(=O)CCc1ccc(c(c1)[N+](=O)[O-])F
Complexity
253
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.6
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CatalogNumber: AA87192
ChemicalName: 3-(4-Fluoro-3-nitrophenyl)propanoic acid
CasNumber: 160877-40-7
MolecularFormula: C9H8FNO4
MolecularWeight: 213.1625
MdlNumber: MFCD25959676
Smiles: OC(=O)CCc1ccc(c(c1)[N+](=O)[O-])F
Complexity: 253
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.6
CatalogNumber:
AA87192
ChemicalName:
3-(4-Fluoro-3-nitrophenyl)propanoic acid
CasNumber:
160877-40-7
MolecularFormula:
C9H8FNO4
MolecularWeight:
213.1625
MdlNumber:
MFCD25959676
Smiles:
OC(=O)CCc1ccc(c(c1)[N+](=O)[O-])F
Complexity:
253
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)NN1CCC(=CC1)c1nnc(o1)c1ccc(cc1)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
CC(=O)Nc1ccc(cc1)S(=O)(=O)NN1CCC(=CC1)c1nnc(o1)c1ccc(cc1)Cl
Complexity:
__
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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ChemicalName: __
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Smiles: C[C@H]1CO1
Complexity: __
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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:
C[C@H]1CO1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
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MdlNumber: __
Smiles: C[C@@H](CBr)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C[C@@H](CBr)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__