Home Carboxys 3,3-Difluorocyclobutane-1,1-dicarboxylic 1-isopropyl ester

3,3-Difluorocyclobutane-1,1-dicarboxylic 1-isopropyl ester

CAS No.:
1225532-90-0
Catalog Number:
AG0017FX
Molecular Formula:
C9H11F2O4-
Molecular Weight:
221.1780
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$213
- +
1g
97%
1 week
United States
$246
- +
5g
97%
1 week
United States
$727
- +
Product Description
Catalog Number:
AG0017FX
Chemical Name:
3,3-Difluorocyclobutane-1,1-dicarboxylic 1-isopropyl ester
CAS Number:
1225532-90-0
Molecular Formula:
C9H11F2O4-
Molecular Weight:
221.1780
MDL Number:
MFCD23105828
IUPAC Name:
3,3-difluoro-1-propan-2-yloxycarbonylcyclobutane-1-carboxylic acid
InChI:
InChI=1S/C9H12F2O4/c1-5(2)15-7(14)8(6(12)13)3-9(10,11)4-8/h5H,3-4H2,1-2H3,(H,12,13)
InChI Key:
WHOOVGTWUYASMU-UHFFFAOYSA-N
SMILES:
CC(OC(=O)C1(CC(C1)(F)F)C(=O)[O-])C
Properties
Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.07g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.188g/mol
Monoisotopic Mass:
222.07g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties