4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid
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4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid
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CAS No:
7079-86-9
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Formula:
C7H6F7NO4
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Chemical Name:
4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid
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Synonyms:
Hexanoic acid,4,4,5,5,6,6,6-heptafluoro-3-(nitromethyl)-;4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid;NSC 108514
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CAS No:
4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid Basic Attributes
301.12 g/mol
301.12
108514
DTXSID60296260
4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid Use and Manufacturing
PFAS (per- and polyfluoroalkyl substances) -> OECD Category
Computed Properties
Molecular Weight:301.12
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:5
Exact Mass:301.01850481
Monoisotopic Mass:301.01850481
Topological Polar Surface Area:83.1
Heavy Atom Count:19
Complexity:361
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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