Home Other Building Blocks 4-hydroxy-4-(trifluoromethyl)cyclohexan-1-one

4-hydroxy-4-(trifluoromethyl)cyclohexan-1-one

CAS No.:
120929-90-0
Catalog Number:
AG01AIVG
Molecular Formula:
C7H9F3O2
Molecular Weight:
182.1404
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$594
- +
Product Description
Catalog Number:
AG01AIVG
Chemical Name:
4-hydroxy-4-(trifluoromethyl)cyclohexan-1-one
CAS Number:
120929-90-0
Molecular Formula:
C7H9F3O2
Molecular Weight:
182.1404
MDL Number:
MFCD18917407
IUPAC Name:
4-hydroxy-4-(trifluoromethyl)cyclohexan-1-one
InChI:
InChI=1S/C7H9F3O2/c8-7(9,10)6(12)3-1-5(11)2-4-6/h12H,1-4H2
InChI Key:
WQEVHVUXWMPHQO-UHFFFAOYSA-N
SMILES:
FC(C1(O)CCC(=O)CC1)(F)F
Properties
Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.055g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
182.142g/mol
Monoisotopic Mass:
182.055g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties