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Home > Encyclopedia > 1,1,1-TRIFLUOROACETONECYANOHYDRIN

1,1,1-TRIFLUOROACETONECYANOHYDRIN

1,1,1-TRIFLUOROACETONECYANOHYDRIN structure

1,1,1-TRIFLUOROACETONECYANOHYDRIN 

structure
  • CAS No:

    335-08-0

  • Formula:

    C4H4F3NO

  • Chemical Name:

    1,1,1-TRIFLUOROACETONECYANOHYDRIN

  • Synonyms:

    NSC120436;TRIFLUOROACETONECYANOHYDRIN;1,1,1-TRIFLUOROACETONECYANHYDRIN;1,1,1-TRIFLUOROACETONECYANOHYDRIN;2-Cyano-1,1,1-trifluoro-2-propanol;1,1,1-Trifluoroacetonecyanohydrine;1,1,1-Trifluoroacetonecyanhydrin95%;1,1,1-Trifluoroacetonecyanhydrin95%;2-HYDROXY-2-(TRIFLUOROMETHYL)PROPIO-&;2-Trifluoromethyl-2-hydroxypropionitrile

  • Categories:

    Organic Chemistry  >  Coordination Complexes

1,1,1-TRIFLUOROACETONECYANOHYDRIN Basic Attributes

139.07600

139.02400

120436

DTXSID00298061

2926909090

Characteristics

44.02000

0.82328

1,276 g/cm3

68 °C

60°C

1.338

Fully miscible in water.

Safety Information

II

6.1

3276

R26/27/28;R50/53

S7/9-S27-S45-S60-S61-S36/37

T: Toxic;Xn: Harmful;

P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P270, P271, P273, P280, P284, P301+P310, P302+P350, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P311, P312, P320, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P370+P378, P391, P403+P233, P403+P235, P405, P501

H226

|Danger|H226 (87.5%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P270, P271, P273, P280, P284, P301+P310, P302+P350, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P311, P312, P320, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P370+P378, P391, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 8 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:139.08
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Exact Mass:139.02449824
Monoisotopic Mass:139.02449824
Topological Polar Surface Area:44
Heavy Atom Count:9
Complexity:155
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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