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Home > Fluorides > 264135-49-1
264135-49-1 | Methanesulfonic acid, 1,1,1-trifluoro-, 2,4-difluorophenyl ester
CAS No: 264135-49-1 Catalog No: AG002T40 MDL No:MFCD07784321
Product Description
Catalog Number:
AG002T40
Chemical Name:
Methanesulfonic acid, 1,1,1-trifluoro-, 2,4-difluorophenyl ester
CAS Number:
264135-49-1
Molecular Formula:
C7H3F5O3S
Molecular Weight:
262.1539
MDL Number:
MFCD07784321
IUPAC Name:
(2,4-difluorophenyl) trifluoromethanesulfonate
InChI:
InChI=1S/C7H3F5O3S/c8-4-1-2-6(5(9)3-4)15-16(13,14)7(10,11)12/h1-3H
InChI Key:
HDPFJBUPWOYJFO-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)F)OS(=O)(=O)C(F)(F)F
Properties
Complexity:
333
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:
2.9
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