AF68925
408366-18-7 | 2-(4-Trifluoromethoxyphenyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AF68925
ChemicalName
2-(4-Trifluoromethoxyphenyl)benzoic acid
CasNumber
408366-18-7
MolecularFormula
C14H9F3O3
MolecularWeight
282.2147
MdlNumber
MFCD04117417
Smiles
OC(=O)c1ccccc1c1ccc(cc1)OC(F)(F)F
Complexity
335
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
4.1
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CatalogNumber: AF68925
ChemicalName: 2-(4-Trifluoromethoxyphenyl)benzoic acid
CasNumber: 408366-18-7
MolecularFormula: C14H9F3O3
MolecularWeight: 282.2147
MdlNumber: MFCD04117417
Smiles: OC(=O)c1ccccc1c1ccc(cc1)OC(F)(F)F
Complexity: 335
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 4.1
CatalogNumber:
AF68925
ChemicalName:
2-(4-Trifluoromethoxyphenyl)benzoic acid
CasNumber:
408366-18-7
MolecularFormula:
C14H9F3O3
MolecularWeight:
282.2147
MdlNumber:
MFCD04117417
Smiles:
OC(=O)c1ccccc1c1ccc(cc1)OC(F)(F)F
Complexity:
335
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
4.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCCc1cnc([nH]1)N
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:
NCCc1cnc([nH]1)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: [C-]#[N+]C(S(=O)(=O)c1ccc(cc1)C)c1ccc2c(c1)OCO2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[C-]#[N+]C(S(=O)(=O)c1ccc(cc1)C)c1ccc2c(c1)OCO2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1cncc2c1CCCN2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1cncc2c1CCCN2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__