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Home > Fluorides > 113673-89-5
113673-89-5 | Benzenesulfonic acid, 4-ethenyl-, (2,3,4,5,6-pentafluorophenyl)methyl ester
CAS No: 113673-89-5 Catalog No: AG00099J MDL No:
Product Description
Catalog Number:
AG00099J
Chemical Name:
Benzenesulfonic acid, 4-ethenyl-, (2,3,4,5,6-pentafluorophenyl)methyl ester
CAS Number:
113673-89-5
Molecular Formula:
C15H9F5O3S
Molecular Weight:
364.2872
IUPAC Name:
(2,3,4,5,6-pentafluorophenyl)methyl 4-ethenylbenzenesulfonate
InChI:
InChI=1S/C15H9F5O3S/c1-2-8-3-5-9(6-4-8)24(21,22)23-7-10-11(16)13(18)15(20)14(19)12(10)17/h2-6H,1,7H2
InChI Key:
WCFXMSLTKRHHMK-UHFFFAOYSA-N
SMILES:
C=Cc1ccc(cc1)S(=O)(=O)OCc1c(F)c(F)c(c(c1F)F)F
Properties
Complexity:
514
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
364.019g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
364.286g/mol
Monoisotopic Mass:
364.019g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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