AB70955
36967-85-8 | Benzoyl trifluoromethanesulfonate
Manufacturer: A2B Chem
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CatalogNumber
AB70955
ChemicalName
Benzoyl trifluoromethanesulfonate
CasNumber
36967-85-8
MolecularFormula
C8H5F3O4S
MolecularWeight
254.1831
MdlNumber
MFCD17013536
Smiles
O=C(c1ccccc1)OS(=O)(=O)C(F)(F)F
Complexity
349
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
7
RotatableBondCount
3
Xlogp3
2.6
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CatalogNumber: AB70955
ChemicalName: Benzoyl trifluoromethanesulfonate
CasNumber: 36967-85-8
MolecularFormula: C8H5F3O4S
MolecularWeight: 254.1831
MdlNumber: MFCD17013536
Smiles: O=C(c1ccccc1)OS(=O)(=O)C(F)(F)F
Complexity: 349
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 7
RotatableBondCount: 3
Xlogp3: 2.6
CatalogNumber:
AB70955
ChemicalName:
Benzoyl trifluoromethanesulfonate
CasNumber:
36967-85-8
MolecularFormula:
C8H5F3O4S
MolecularWeight:
254.1831
MdlNumber:
MFCD17013536
Smiles:
O=C(c1ccccc1)OS(=O)(=O)C(F)(F)F
Complexity:
349
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
7
RotatableBondCount:
3
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOCCOC(=O)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOCCOC(=O)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCC(COC(=O)c1ccccc1)CC
Complexity: 207
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 4.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCC(COC(=O)c1ccccc1)CC
Complexity:
207
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
4.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1ccccc1)OCC=C(C)C
Complexity: 208
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1ccccc1)OCC=C(C)C
Complexity:
208
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.2