AF56800
364064-17-5 | 5-(4-Fluorophenyl)nicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AF56800
ChemicalName
5-(4-Fluorophenyl)nicotinic acid
CasNumber
364064-17-5
MolecularFormula
C12H8FNO2
MolecularWeight
217.1958
MdlNumber
MFCD06410260
Smiles
Fc1ccc(cc1)c1cncc(c1)C(=O)O
Complexity
251
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.1
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CatalogNumber: AF56800
ChemicalName: 5-(4-Fluorophenyl)nicotinic acid
CasNumber: 364064-17-5
MolecularFormula: C12H8FNO2
MolecularWeight: 217.1958
MdlNumber: MFCD06410260
Smiles: Fc1ccc(cc1)c1cncc(c1)C(=O)O
Complexity: 251
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AF56800
ChemicalName:
5-(4-Fluorophenyl)nicotinic acid
CasNumber:
364064-17-5
MolecularFormula:
C12H8FNO2
MolecularWeight:
217.1958
MdlNumber:
MFCD06410260
Smiles:
Fc1ccc(cc1)c1cncc(c1)C(=O)O
Complexity:
251
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: C=C(C(=O)[O-])Cl.[Na+]
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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Smiles:
C=C(C(=O)[O-])Cl.[Na+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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MolecularFormula: __
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Smiles: CCC(C1=CC=CC=C1)N
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:
CCC(C1=CC=CC=C1)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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MdlNumber: __
Smiles: OC[C@H](C(CCCC[C@H](C/C(=C/C(=C/C(=O)O)/C)/C)C)O)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@H](C(CCCC[C@H](C/C(=C/C(=C/C(=O)O)/C)/C)C)O)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__