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422-64-0 | 2,2,3,3,3-Pentafluoropropanoic acid
CAS No: 422-64-0 Catalog No: AG003TNF MDL No:MFCD00004170
Product Description
Catalog Number:
AG003TNF
Chemical Name:
2,2,3,3,3-Pentafluoropropanoic acid
CAS Number:
422-64-0
Molecular Formula:
C3HF5O2
Molecular Weight:
164.0309
MDL Number:
MFCD00004170
IUPAC Name:
2,2,3,3,3-pentafluoropropanoic acid
InChI:
InChI=1S/C3HF5O2/c4-2(5,1(9)10)3(6,7)8/h(H,9,10)
InChI Key:
LRMSQVBRUNSOJL-UHFFFAOYSA-N
SMILES:
OC(=O)C(C(F)(F)F)(F)F
EC Number:
207-021-6
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.99g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.031g/mol
Monoisotopic Mass:
163.99g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
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