2-(4,4,5,5,6,6,6-Heptafluorohexyl)propanedioic acid
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2-(4,4,5,5,6,6,6-Heptafluorohexyl)propanedioic acid
structure -
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CAS No:
244022-64-8
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Formula:
C9H9F7O4
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Chemical Name:
2-(4,4,5,5,6,6,6-Heptafluorohexyl)propanedioic acid
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Synonyms:
Propanedioic acid,2-(4,4,5,5,6,6,6-heptafluorohexyl)-;Propanedioic acid,(4,4,5,5,6,6,6-heptafluorohexyl)-;2-(4,4,5,5,6,6,6-Heptafluorohexyl)propanedioic acid;2-(4,4,5,5,6,6,6-Heptafluorohexyl)malonic acid
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CAS No:
2-(4,4,5,5,6,6,6-Heptafluorohexyl)propanedioic acid Basic Attributes
314.15400
314.15
DTXSID90379272
2917190090
Characteristics
74.60000
2.77500
1.532g/cm3
114-115ºC
319ºC at 760 mmHg
146.8ºC
1.383
7.29E-05mmHg at 25°C
Safety Information
Xi
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
2-(4,4,5,5,6,6,6-Heptafluorohexyl)propanedioic acid Use and Manufacturing
PFAS (per- and polyfluoroalkyl substances) -> OECD Category
Computed Properties
Molecular Weight:314.15
XLogP3:3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:7
Exact Mass:314.03890590
Monoisotopic Mass:314.03890590
Topological Polar Surface Area:74.6
Heavy Atom Count:20
Complexity:363
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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