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2,2,3,3-Tetrafluoropropionic acid

CAT: 0024-sc-260165Size: 5 gDry Ice: NoHazardous: No
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CAS Number
756-09-2

Chemical Information

Flupropanate

Flupropanate is an organohalogen compound and a carboxylic acid.

CAS Number756-09-2
PubChem CID69789
IUPAC Name2,2,3,3-tetrafluoropropanoic acid
Molecular FormulaC3H2F4O2
Molecular Weight146.04
XLogP1.3
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count9
Formal Charge0
Complexity121
SMILES
C(C(C(=O)O)(F)F)(F)F
InChI
InChI=1S/C3H2F4O2/c4-1(5)3(6,7)2(8)9/h1H,(H,8,9)
InChIKey
PXRROZVNOOEPPZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Flupropanate
CAS: 756-09-2
CID: 69789
Formula: C3H2F4O2
MW: 146.04
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight146.04
XLogP31.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass145.99909195
Monoisotopic Mass145.99909195
Topological Polar Surface Area37.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity121
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes