AI61958
926220-09-9 | 4-[2-(Trifluoromethoxy)phenyl]benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AI61958
ChemicalName
4-[2-(Trifluoromethoxy)phenyl]benzoic acid
CasNumber
926220-09-9
MolecularFormula
C14H9F3O3
MolecularWeight
282.2147
MdlNumber
MFCD09042195
Smiles
OC(=O)c1ccc(cc1)c1ccccc1OC(F)(F)F
Complexity
335
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
4.3
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CatalogNumber: AI61958
ChemicalName: 4-[2-(Trifluoromethoxy)phenyl]benzoic acid
CasNumber: 926220-09-9
MolecularFormula: C14H9F3O3
MolecularWeight: 282.2147
MdlNumber: MFCD09042195
Smiles: OC(=O)c1ccc(cc1)c1ccccc1OC(F)(F)F
Complexity: 335
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 4.3
CatalogNumber:
AI61958
ChemicalName:
4-[2-(Trifluoromethoxy)phenyl]benzoic acid
CasNumber:
926220-09-9
MolecularFormula:
C14H9F3O3
MolecularWeight:
282.2147
MdlNumber:
MFCD09042195
Smiles:
OC(=O)c1ccc(cc1)c1ccccc1OC(F)(F)F
Complexity:
335
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
4.3
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1=CC(=C(C=C1C2=CC(=C(C=C2)Cl)Cl)C=O)O
Complexity: __
Covalently-bondedUnitCount: __
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:
C1=CC(=C(C=C1C2=CC(=C(C=C2)Cl)Cl)C=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cc(ccc1F)c1ccc(cc1)C(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cc(ccc1F)c1ccc(cc1)C(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC1=CC(=C(C=C1)C2=CC=CS2)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=CS2)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__