Home Carboxys 3,3-Difluorocyclohexanecarboxylic acid

3,3-Difluorocyclohexanecarboxylic acid

CAS No.:
849669-20-1
Catalog Number:
AG00G9XC
Molecular Formula:
C7H10F2O2
Molecular Weight:
164.1499
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00G9XC
Chemical Name:
3,3-Difluorocyclohexanecarboxylic acid
CAS Number:
849669-20-1
Molecular Formula:
C7H10F2O2
Molecular Weight:
164.1499
MDL Number:
MFCD18910122
IUPAC Name:
3,3-difluorocyclohexane-1-carboxylic acid
InChI:
InChI=1S/C7H10F2O2/c8-7(9)3-1-2-5(4-7)6(10)11/h5H,1-4H2,(H,10,11)
InChI Key:
GSVZSOJKYXYXAX-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCCC(C1)(F)F
Properties
Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.065g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
164.152g/mol
Monoisotopic Mass:
164.065g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties