AB63478
51903-64-1 | 4-Methyl-3-(trifluoromethyl)phenylisocyanate
Manufacturer: A2B Chem
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CatalogNumber
AB63478
ChemicalName
4-Methyl-3-(trifluoromethyl)phenylisocyanate
CasNumber
51903-64-1
MolecularFormula
C9H6F3NO
MolecularWeight
201.1452
MdlNumber
MFCD03427212
Smiles
O=C=Nc1ccc(c(c1)C(F)(F)F)C
Complexity
245
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
RotatableBondCount
1
Xlogp3
4
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CatalogNumber: AB63478
ChemicalName: 4-Methyl-3-(trifluoromethyl)phenylisocyanate
CasNumber: 51903-64-1
MolecularFormula: C9H6F3NO
MolecularWeight: 201.1452
MdlNumber: MFCD03427212
Smiles: O=C=Nc1ccc(c(c1)C(F)(F)F)C
Complexity: 245
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 4
CatalogNumber:
AB63478
ChemicalName:
4-Methyl-3-(trifluoromethyl)phenylisocyanate
CasNumber:
51903-64-1
MolecularFormula:
C9H6F3NO
MolecularWeight:
201.1452
MdlNumber:
MFCD03427212
Smiles:
O=C=Nc1ccc(c(c1)C(F)(F)F)C
Complexity:
245
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)Nc1cccc(c1)C(F)(F)F
Complexity: 215
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)Nc1cccc(c1)C(F)(F)F
Complexity:
215
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.6
CatalogNumber: AB63480
ChemicalName: 3-(Trifluoromethyl)benzenesulfonyl chloride
CasNumber: 777-44-6
MolecularFormula: C7H4ClF3O2S
MolecularWeight: 244.6186696
MdlNumber: MFCD00014724
Smiles: FC(c1cccc(c1)S(=O)(=O)Cl)(F)F
Complexity: 293
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 2.8
CatalogNumber:
AB63480
ChemicalName:
3-(Trifluoromethyl)benzenesulfonyl chloride
CasNumber:
777-44-6
MolecularFormula:
C7H4ClF3O2S
MolecularWeight:
244.6186696
MdlNumber:
MFCD00014724
Smiles:
FC(c1cccc(c1)S(=O)(=O)Cl)(F)F
Complexity:
293
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(c1cccc(c1)C(F)(F)F)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(c1cccc(c1)C(F)(F)F)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__