AD35618
1179797-95-5 | 4-(5-Fluoro-2-methylphenyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AD35618
ChemicalName
4-(5-Fluoro-2-methylphenyl)benzoic acid
CasNumber
1179797-95-5
MolecularFormula
C14H11FO2
MolecularWeight
230.2343
MdlNumber
MFCD12859220
Smiles
Fc1ccc(c(c1)c1ccc(cc1)C(=O)O)C
Complexity
271
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3.5
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CatalogNumber: AD35618
ChemicalName: 4-(5-Fluoro-2-methylphenyl)benzoic acid
CasNumber: 1179797-95-5
MolecularFormula: C14H11FO2
MolecularWeight: 230.2343
MdlNumber: MFCD12859220
Smiles: Fc1ccc(c(c1)c1ccc(cc1)C(=O)O)C
Complexity: 271
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.5
CatalogNumber:
AD35618
ChemicalName:
4-(5-Fluoro-2-methylphenyl)benzoic acid
CasNumber:
1179797-95-5
MolecularFormula:
C14H11FO2
MolecularWeight:
230.2343
MdlNumber:
MFCD12859220
Smiles:
Fc1ccc(c(c1)c1ccc(cc1)C(=O)O)C
Complexity:
271
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.5
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Smiles: CC(=O)c1ccc(cc1)c1ccc(c(c1)C)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CC(=O)c1ccc(cc1)c1ccc(c(c1)C)F
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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__
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Smiles: N#CCc1ccc(cc1)OCC(F)F
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
N#CCc1ccc(cc1)OCC(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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ChemicalName: __
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Smiles: NCCCN(C(=O)OCc1ccccc1)C.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCCCN(C(=O)OCc1ccccc1)C.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__