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Home > Encyclopedia > 2,2,3,4,4,5,5,6,6,7,8,8,8-tridecafluoro-3,7-bis(trifluoromethyl)octanoic acid

2,2,3,4,4,5,5,6,6,7,8,8,8-tridecafluoro-3,7-bis(trifluoromethyl)octanoic acid

2,2,3,4,4,5,5,6,6,7,8,8,8-tridecafluoro-3,7-bis(trifluoromethyl)octanoic acid structure

2,2,3,4,4,5,5,6,6,7,8,8,8-tridecafluoro-3,7-bis(trifluoromethyl)octanoic acid 

structure
  • CAS No:

    172155-07-6

  • Formula:

    C10HF19O2

  • Chemical Name:

    2,2,3,4,4,5,5,6,6,7,8,8,8-tridecafluoro-3,7-bis(trifluoromethyl)octanoic acid

  • Synonyms:

    PC1214;

  • Categories:

    Organic Chemistry  >  Coordination Complexes

2,2,3,4,4,5,5,6,6,7,8,8,8-tridecafluoro-3,7-bis(trifluoromethyl)octanoic acid Basic Attributes

514.08300

513.9673143

DTXSID40379808

Characteristics

37.30000

5.71570

1.759g/cm3

90ºC

73.1ºC

1.288

0.162mmHg at 25°C

Safety Information

UN 3265

R34

S26; S36/37/39

Xi; C

|Danger|H314 (66.67%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P261, P264, P271, P280, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 3 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

2,2,3,4,4,5,5,6,6,7,8,8,8-tridecafluoro-3,7-bis(trifluoromethyl)octanoic acid Use and Manufacturing

PFAS (per- and polyfluoroalkyl substances) -> OECD Category

Computed Properties

Molecular Weight:514.08
XLogP3:6.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:21
Rotatable Bond Count:6
Exact Mass:513.9673143
Monoisotopic Mass:513.9673143
Topological Polar Surface Area:37.3
Heavy Atom Count:31
Complexity:682
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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