3,3'-Sulfanediylbis(4,4,5,5,6,6,6-heptafluorohexanoic acid) structure

3,3'-Sulfanediylbis(4,4,5,5,6,6,6-heptafluorohexanoic acid)

3-(1-carboxy-3,3,4,4,5,5,5-heptafluoropentan-2-yl)sulfanyl-4,4,5,5,6,6,6-heptafluorohexanoic acid

Also Known As: 3,3'-sulfanediylbis(4,4,5,5,6,6,6-heptafluorohexanoic acid)|Hexanoic acid,3,3'-thiobis[4,4,5,5,6,6,6-heptafluoro-|3-(1-carboxy-3,3,4,4,5,5,5-heptafluoropentan-2-yl)sulfanyl-4|4,4,5,5,6,6,6-heptafluoro-3-(4,4,5,5,6,6,6-heptafluoro-1-hydroxy-1-oxohexan-3-yl)sulfanylhexanoic acid

CAS: 31377-23-8
Molecular Formula C12H8F14O4S
Molecular Weight 513.992 g/mol
LogP 4.9
Topological Polar Surface Area 99.9 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 19
Rotatable Bonds 10
Exact Mass 513.992
Monoisotopic Mass 513.992
Heavy Atoms 31
Complexity 615.0

Chemical Identifiers

CAS Number 31377-23-8
SMILES C(C(C(C(C(F)(F)F)(F)F)(F)F)SC(CC(=O)O)C(C(C(F)(F)F)(F)F)(F)F)C(=O)O
InChIKey WRVMOWWHPGYRJJ-UHFFFAOYSA-N

Product Overview

3,3'-Sulfanediylbis(4,4,5,5,6,6,6-heptafluorohexanoic acid) (CAS 31377-23-8), with molecular formula C12H8F14O4S and molecular weight 513.992 g/mol. IUPAC: 3-(1-carboxy-3,3,4,4,5,5,5-heptafluoropentan-2-yl)sulfanyl-4,4,5,5,6,6,6-heptafluorohexanoic acid.

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3,3'-Sulfanediylbis(4,4,5,5,6,6,6-heptafluorohexanoic acid) is a custom synthesis product. We offer services from milligram to kilogram scale.

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