Home Other Building Blocks 3-(difluoromethyl)cyclohexan-1-one

3-(difluoromethyl)cyclohexan-1-one

CAS No.:
1355729-67-7
Catalog Number:
AG019ZKI
Molecular Formula:
C7H10F2O
Molecular Weight:
148.1505
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Product Description
Catalog Number:
AG019ZKI
Chemical Name:
3-(difluoromethyl)cyclohexan-1-one
CAS Number:
1355729-67-7
Molecular Formula:
C7H10F2O
Molecular Weight:
148.1505
MDL Number:
MFCD24445639
IUPAC Name:
3-(difluoromethyl)cyclohexan-1-one
InChI:
InChI=1S/C7H10F2O/c8-7(9)5-2-1-3-6(10)4-5/h5,7H,1-4H2
InChI Key:
AOXSKWSBHVVGMI-UHFFFAOYSA-N
SMILES:
O=C1CCCC(C1)C(F)F
Properties
Complexity:
134  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.07g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.153g/mol
Monoisotopic Mass:
148.07g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties