AI52043
537713-35-2 | 5-Fluoro-2-(4-trifluoromethylphenyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AI52043
ChemicalName
5-Fluoro-2-(4-trifluoromethylphenyl)benzoic acid
CasNumber
537713-35-2
MolecularFormula
C14H8F4O2
MolecularWeight
284.2057
MdlNumber
MFCD18321786
Smiles
Fc1ccc(c(c1)C(=O)O)c1ccc(cc1)C(F)(F)F
Complexity
348
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
4.1
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CatalogNumber: AI52043
ChemicalName: 5-Fluoro-2-(4-trifluoromethylphenyl)benzoic acid
CasNumber: 537713-35-2
MolecularFormula: C14H8F4O2
MolecularWeight: 284.2057
MdlNumber: MFCD18321786
Smiles: Fc1ccc(c(c1)C(=O)O)c1ccc(cc1)C(F)(F)F
Complexity: 348
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 4.1
CatalogNumber:
AI52043
ChemicalName:
5-Fluoro-2-(4-trifluoromethylphenyl)benzoic acid
CasNumber:
537713-35-2
MolecularFormula:
C14H8F4O2
MolecularWeight:
284.2057
MdlNumber:
MFCD18321786
Smiles:
Fc1ccc(c(c1)C(=O)O)c1ccc(cc1)C(F)(F)F
Complexity:
348
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
4.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC1=CC(=C(C=C1)C2=CC=C(C=C2)Cl)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC1=CC(=C(C=C1)C2=CC=C(C=C2)Cl)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1c(C)cccc1c1ccc(cc1)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1c(C)cccc1c1ccc(cc1)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI52046
ChemicalName: 4'-Methoxy-2'-methylpropiophenone
CasNumber: 53773-76-5
MolecularFormula: C11H14O2
MolecularWeight: 178.2277
MdlNumber: MFCD11617652
Smiles: CCC(=O)c1ccc(cc1C)OC
Complexity: 177
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 2.4
CatalogNumber:
AI52046
ChemicalName:
4'-Methoxy-2'-methylpropiophenone
CasNumber:
53773-76-5
MolecularFormula:
C11H14O2
MolecularWeight:
178.2277
MdlNumber:
MFCD11617652
Smiles:
CCC(=O)c1ccc(cc1C)OC
Complexity:
177
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
2.4