Home Carboxys 4-Hydroxy-4-(trifluoromethyl)cyclohexanecarboxylic acid

4-Hydroxy-4-(trifluoromethyl)cyclohexanecarboxylic acid

CAS No.:
1163729-47-2
Catalog Number:
AG000CC4
Molecular Formula:
C8H11F3O3
Molecular Weight:
212.1663
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95+%
1 week
United States
$63
- +
250mg
95+%
1 week
United States
$109
- +
Product Description
Catalog Number:
AG000CC4
Chemical Name:
4-Hydroxy-4-(trifluoromethyl)cyclohexanecarboxylic acid
CAS Number:
1163729-47-2
Molecular Formula:
C8H11F3O3
Molecular Weight:
212.1663
MDL Number:
MFCD13659409
IUPAC Name:
4-hydroxy-4-(trifluoromethyl)cyclohexane-1-carboxylic acid
InChI:
InChI=1S/C8H11F3O3/c9-8(10,11)7(14)3-1-5(2-4-7)6(12)13/h5,14H,1-4H2,(H,12,13)
InChI Key:
FIUBKGKIMNZJSO-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCC(CC1)(O)C(F)(F)F
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.066g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
212.168g/mol
Monoisotopic Mass:
212.066g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties