Home Carboxys 2,2-Difluorocyclobutanecarboxylic acid

2,2-Difluorocyclobutanecarboxylic acid

CAS No.:
1150518-74-3
Catalog Number:
AG00HCXU
Molecular Formula:
C5H6F2O2
Molecular Weight:
136.0967
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25mg
95%
1 week
United States
$942
- +
100mg
95%
1 week
United States
$2298
- +
Product Description
Catalog Number:
AG00HCXU
Chemical Name:
2,2-Difluorocyclobutanecarboxylic acid
CAS Number:
1150518-74-3
Molecular Formula:
C5H6F2O2
Molecular Weight:
136.0967
MDL Number:
MFCD09834759
IUPAC Name:
2,2-difluorocyclobutane-1-carboxylic acid
InChI:
InChI=1S/C5H6F2O2/c6-5(7)2-1-3(5)4(8)9/h3H,1-2H2,(H,8,9)
InChI Key:
CEDIFJKUTKENCU-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCC1(F)F
Properties
Complexity:
144  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.034g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
136.098g/mol
Monoisotopic Mass:
136.034g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties