AD24498
505082-81-5 | 4-(3,4-Difluorophenyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AD24498
ChemicalName
4-(3,4-Difluorophenyl)benzoic acid
CasNumber
505082-81-5
MolecularFormula
C13H8F2O2
MolecularWeight
234.1982
MdlNumber
MFCD03839978
Smiles
OC(=O)c1ccc(cc1)c1ccc(c(c1)F)F
Complexity
275
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3.3
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CatalogNumber: AD24498
ChemicalName: 4-(3,4-Difluorophenyl)benzoic acid
CasNumber: 505082-81-5
MolecularFormula: C13H8F2O2
MolecularWeight: 234.1982
MdlNumber: MFCD03839978
Smiles: OC(=O)c1ccc(cc1)c1ccc(c(c1)F)F
Complexity: 275
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.3
CatalogNumber:
AD24498
ChemicalName:
4-(3,4-Difluorophenyl)benzoic acid
CasNumber:
505082-81-5
MolecularFormula:
C13H8F2O2
MolecularWeight:
234.1982
MdlNumber:
MFCD03839978
Smiles:
OC(=O)c1ccc(cc1)c1ccc(c(c1)F)F
Complexity:
275
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.3
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Smiles: CC(c1[nH]c2c(n1)cc(cc2)C(=O)O)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Smiles:
CC(c1[nH]c2c(n1)cc(cc2)C(=O)O)C
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Smiles: Fc1ccc(cc1)c1c(F)c(F)cc(c1F)F
Complexity: __
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Smiles:
Fc1ccc(cc1)c1c(F)c(F)cc(c1F)F
Complexity:
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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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Smiles: OC(=O)CCN1CCCCCC1=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CCN1CCCCCC1=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__