AA35931
1261593-39-8 | 4-Fluoro-3-(3-trifluoromethylphenyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA35931
ChemicalName
4-Fluoro-3-(3-trifluoromethylphenyl)benzoic acid
CasNumber
1261593-39-8
MolecularFormula
C14H8F4O2
MolecularWeight
284.2057
MdlNumber
MFCD18321760
Smiles
OC(=O)c1ccc(c(c1)c1cccc(c1)C(F)(F)F)F
Complexity
356
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
4.1
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CatalogNumber: AA35931
ChemicalName: 4-Fluoro-3-(3-trifluoromethylphenyl)benzoic acid
CasNumber: 1261593-39-8
MolecularFormula: C14H8F4O2
MolecularWeight: 284.2057
MdlNumber: MFCD18321760
Smiles: OC(=O)c1ccc(c(c1)c1cccc(c1)C(F)(F)F)F
Complexity: 356
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 4.1
CatalogNumber:
AA35931
ChemicalName:
4-Fluoro-3-(3-trifluoromethylphenyl)benzoic acid
CasNumber:
1261593-39-8
MolecularFormula:
C14H8F4O2
MolecularWeight:
284.2057
MdlNumber:
MFCD18321760
Smiles:
OC(=O)c1ccc(c(c1)c1cccc(c1)C(F)(F)F)F
Complexity:
356
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
4.1
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Smiles: Fc1cc(ccc1c1ccccc1OC(F)(F)F)C(=O)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
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Smiles:
Fc1cc(ccc1c1ccccc1OC(F)(F)F)C(=O)O
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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Smiles: Nc1ccncc1c1cccc(c1)C(F)(F)F
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Smiles:
Nc1ccncc1c1cccc(c1)C(F)(F)F
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: COC(=O)Cc1csc(n1)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)Cc1csc(n1)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__