AG19185
431-37-8 | 1-Chloro-3,3,3-trifluoroacetone
Manufacturer: A2B Chem
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CatalogNumber
AG19185
ChemicalName
1-Chloro-3,3,3-trifluoroacetone
CasNumber
431-37-8
MolecularFormula
C3H2ClF3O
MolecularWeight
146.4956
MdlNumber
MFCD01631508
Smiles
ClCC(=O)C(F)(F)F
Complexity
97.2
Covalently-bondedUnitCount
1
HeavyAtomCount
8
HydrogenBondAcceptorCount
4
RotatableBondCount
1
Xlogp3
1.7
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CatalogNumber: AG19185
ChemicalName: 1-Chloro-3,3,3-trifluoroacetone
CasNumber: 431-37-8
MolecularFormula: C3H2ClF3O
MolecularWeight: 146.4956
MdlNumber: MFCD01631508
Smiles: ClCC(=O)C(F)(F)F
Complexity: 97.2
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 1.7
CatalogNumber:
AG19185
ChemicalName:
1-Chloro-3,3,3-trifluoroacetone
CasNumber:
431-37-8
MolecularFormula:
C3H2ClF3O
MolecularWeight:
146.4956
MdlNumber:
MFCD01631508
Smiles:
ClCC(=O)C(F)(F)F
Complexity:
97.2
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(/C=C/C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(/C=C/C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AG19187
ChemicalName: 4H-1-Benzopyran-4-one
CasNumber: 491-38-3
MolecularFormula: C9H6O2
MolecularWeight: 146.1427
MdlNumber: MFCD00024064
Smiles: O=c1ccoc2c1cccc2
Complexity: 196
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: __
Xlogp3: 1.4
CatalogNumber:
AG19187
ChemicalName:
4H-1-Benzopyran-4-one
CasNumber:
491-38-3
MolecularFormula:
C9H6O2
MolecularWeight:
146.1427
MdlNumber:
MFCD00024064
Smiles:
O=c1ccoc2c1cccc2
Complexity:
196
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
__
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O/N=C/c1cccc(c1Cl)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O/N=C/c1cccc(c1Cl)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__