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Home > Fluorides > 162082-63-5
162082-63-5 | 1-Octanol, 5,5,6,6,7,7,8,8,8-nonafluoro-, 1-(4-methylbenzenesulfonate)
CAS No: 162082-63-5 Catalog No: AG001SQD MDL No:
Product Description
Catalog Number:
AG001SQD
Chemical Name:
1-Octanol, 5,5,6,6,7,7,8,8,8-nonafluoro-, 1-(4-methylbenzenesulfonate)
CAS Number:
162082-63-5
IUPAC Name:
4-methylbenzenesulfonic acid;5,5,6,6,7,7,8,8,8-nonafluorooctan-1-ol
InChI:
InChI=1S/C8H9F9O.C7H8O3S/c9-5(10,3-1-2-4-18)6(11,12)7(13,14)8(15,16)17;1-6-2-4-7(5-3-6)11(8,9)10/h18H,1-4H2;2-5H,1H3,(H,8,9,10)
InChI Key:
GCYGDWPIUPIHOE-UHFFFAOYSA-N
Properties
Complexity:
477
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
464.07g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
13
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
464.343g/mol
Monoisotopic Mass:
464.07g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
83A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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