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115432-29-6 | Butanoic acid, 2,2,3,3,4,4-hexafluoro-4-sulfino-
CAS No: 115432-29-6 Catalog No: AG000FZY MDL No:
Product Description
Catalog Number:
AG000FZY
Chemical Name:
Butanoic acid, 2,2,3,3,4,4-hexafluoro-4-sulfino-
CAS Number:
115432-29-6
Molecular Formula:
C4H2F6O4S
Molecular Weight:
260.1117
IUPAC Name:
2,2,3,3,4,4-hexafluoro-4-sulfinobutanoic acid
InChI:
InChI=1S/C4H2F6O4S/c5-2(6,1(11)12)3(7,8)4(9,10)15(13)14/h(H,11,12)(H,13,14)
InChI Key:
KWUPZKVSMNUGLV-UHFFFAOYSA-N
SMILES:
OC(=O)C(C(C(S(=O)O)(F)F)(F)F)(F)F
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.958g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
11
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
260.106g/mol
Monoisotopic Mass:
259.958g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
93.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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