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Home > Fluorides > 161912-36-3
161912-36-3 | Phenol, 2,3,4,5,6-pentafluoro-, 1-methanesulfonate
CAS No: 161912-36-3 Catalog No: AG001SIT MDL No:MFCD06659544
Product Description
Catalog Number:
AG001SIT
Chemical Name:
Phenol, 2,3,4,5,6-pentafluoro-, 1-methanesulfonate
CAS Number:
161912-36-3
Molecular Formula:
C7H3F5O3S
Molecular Weight:
262.1539
MDL Number:
MFCD06659544
IUPAC Name:
(2,3,4,5,6-pentafluorophenyl) methanesulfonate
InChI:
InChI=1S/C7H3F5O3S/c1-16(13,14)15-7-5(11)3(9)2(8)4(10)6(7)12/h1H3
InChI Key:
ARSIBVWMPYUPQT-UHFFFAOYSA-N
SMILES:
Fc1c(OS(=O)(=O)C)c(F)c(c(c1F)F)F
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.972g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.15g/mol
Monoisotopic Mass:
261.972g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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