AG20952
55579-69-6 | 5-[4-(Trifluoromethyl)phenyl]cyclohexane-1,3-dione
Manufacturer: A2B Chem
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CatalogNumber
AG20952
ChemicalName
5-[4-(Trifluoromethyl)phenyl]cyclohexane-1,3-dione
CasNumber
55579-69-6
MolecularFormula
C13H11F3O2
MolecularWeight
256.2204
MdlNumber
MFCD00104794
Smiles
OC1=CC(=O)CC(C1)c1ccc(cc1)C(F)(F)F
Complexity
325
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
RotatableBondCount
1
Xlogp3
2.3
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CatalogNumber: AG20952
ChemicalName: 5-[4-(Trifluoromethyl)phenyl]cyclohexane-1,3-dione
CasNumber: 55579-69-6
MolecularFormula: C13H11F3O2
MolecularWeight: 256.2204
MdlNumber: MFCD00104794
Smiles: OC1=CC(=O)CC(C1)c1ccc(cc1)C(F)(F)F
Complexity: 325
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 2.3
CatalogNumber:
AG20952
ChemicalName:
5-[4-(Trifluoromethyl)phenyl]cyclohexane-1,3-dione
CasNumber:
55579-69-6
MolecularFormula:
C13H11F3O2
MolecularWeight:
256.2204
MdlNumber:
MFCD00104794
Smiles:
OC1=CC(=O)CC(C1)c1ccc(cc1)C(F)(F)F
Complexity:
325
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ncc(c(c1)OC)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ncc(c(c1)OC)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AG20954
ChemicalName: 6-Bromo-8-chloroimidazo[1,2-a]pyridine
CasNumber: 474708-88-8
MolecularFormula: C7H4BrClN2
MolecularWeight: 231.47706
MdlNumber: MFCD11518983
Smiles: Brc1cc(Cl)c2n(c1)ccn2
Complexity: 155
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
RotatableBondCount: __
Xlogp3: 3.1
CatalogNumber:
AG20954
ChemicalName:
6-Bromo-8-chloroimidazo[1,2-a]pyridine
CasNumber:
474708-88-8
MolecularFormula:
C7H4BrClN2
MolecularWeight:
231.47706
MdlNumber:
MFCD11518983
Smiles:
Brc1cc(Cl)c2n(c1)ccn2
Complexity:
155
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
RotatableBondCount:
__
Xlogp3:
3.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Oc1cc(Br)c2c(c1)nc(o2)c1ccc(c(c1)F)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Oc1cc(Br)c2c(c1)nc(o2)c1ccc(c(c1)F)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__