AB54314
886497-85-4 | 2-Fluoro-5-(trifluoromethoxy)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB54314
ChemicalName
2-Fluoro-5-(trifluoromethoxy)benzoic acid
CasNumber
886497-85-4
MolecularFormula
C8H4F4O3
MolecularWeight
224.1092
MdlNumber
MFCD04115887
Smiles
OC(=O)c1cc(ccc1F)OC(F)(F)F
Complexity
241
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.7
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CatalogNumber: AB54314
ChemicalName: 2-Fluoro-5-(trifluoromethoxy)benzoic acid
CasNumber: 886497-85-4
MolecularFormula: C8H4F4O3
MolecularWeight: 224.1092
MdlNumber: MFCD04115887
Smiles: OC(=O)c1cc(ccc1F)OC(F)(F)F
Complexity: 241
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AB54314
ChemicalName:
2-Fluoro-5-(trifluoromethoxy)benzoic acid
CasNumber:
886497-85-4
MolecularFormula:
C8H4F4O3
MolecularWeight:
224.1092
MdlNumber:
MFCD04115887
Smiles:
OC(=O)c1cc(ccc1F)OC(F)(F)F
Complexity:
241
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.7
CatalogNumber: AB54315
ChemicalName: 2-Fluoro-5-(trifluoromethoxy)benzylamine
CasNumber: 886498-13-1
MolecularFormula: C8H7F4NO
MolecularWeight: 209.1408928
MdlNumber: MFCD04115895
Smiles: NCc1cc(ccc1F)OC(F)(F)F
Complexity: 185
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AB54315
ChemicalName:
2-Fluoro-5-(trifluoromethoxy)benzylamine
CasNumber:
886498-13-1
MolecularFormula:
C8H7F4NO
MolecularWeight:
209.1408928
MdlNumber:
MFCD04115895
Smiles:
NCc1cc(ccc1F)OC(F)(F)F
Complexity:
185
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccc(c(c1)C(=O)C)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccc(c(c1)C(=O)C)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(C)ccc1F
Complexity: 105
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(C)ccc1F
Complexity:
105
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.5