AB28996
26107-80-2 | Methyl 3,5-bis(trifluoromethyl)benzoate
Manufacturer: A2B Chem
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CatalogNumber
AB28996
ChemicalName
Methyl 3,5-bis(trifluoromethyl)benzoate
CasNumber
26107-80-2
MolecularFormula
C10H6F6O2
MolecularWeight
272.1439
MdlNumber
MFCD00052317
Smiles
COC(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
Complexity
287
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
8
RotatableBondCount
2
Xlogp3
3.5
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CatalogNumber: AB28996
ChemicalName: Methyl 3,5-bis(trifluoromethyl)benzoate
CasNumber: 26107-80-2
MolecularFormula: C10H6F6O2
MolecularWeight: 272.1439
MdlNumber: MFCD00052317
Smiles: COC(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
Complexity: 287
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 8
RotatableBondCount: 2
Xlogp3: 3.5
CatalogNumber:
AB28996
ChemicalName:
Methyl 3,5-bis(trifluoromethyl)benzoate
CasNumber:
26107-80-2
MolecularFormula:
C10H6F6O2
MolecularWeight:
272.1439
MdlNumber:
MFCD00052317
Smiles:
COC(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
Complexity:
287
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
8
RotatableBondCount:
2
Xlogp3:
3.5
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Smiles: COC(=O)c1cc(ccc1Cl)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COC(=O)c1cc(ccc1Cl)C(F)(F)F
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: [O-]C(=O)C.[O-]C(=O)C.[O-]C(=O)C.[Rh+3]
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HydrogenBondAcceptorCount: __
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CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
[O-]C(=O)C.[O-]C(=O)C.[O-]C(=O)C.[Rh+3]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__