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Home > Encyclopedia > Pentafluorophenyl isocyanate

Pentafluorophenyl isocyanate

Pentafluorophenyl isocyanate structure

Pentafluorophenyl isocyanate 

structure
  • CAS No:

    1591-95-3

  • Formula:

    C7F5NO

  • Chemical Name:

    Pentafluorophenyl isocyanate

  • Synonyms:

    Benzene,1,2,3,4,5-pentafluoro-6-isocyanato-;Isocyanic acid,pentafluorophenyl ester;Benzene,pentafluoroisocyanato-;1,2,3,4,5-Pentafluoro-6-isocyanatobenzene;Perfluorophenyl isocyanate;Pentafluorophenyl isocyanate;Pentafluoroisocyanatobenzene;2,3,4,5,6-PentafluoroPhenyl isocyanate

Pentafluorophenyl isocyanate Basic Attributes

209.07300

209.07

216-470-7

DTXSID90166583

2929109000

Characteristics

29.43000

2.34940

1.56g/cm3

58-59 °C @ Press: 25 Torr

67.6ºC

n20/D 1.449(lit.)

Safety Information

UN 2206 6.1/PG 3

20/21/22-36/37/38

23-26-36

Xn

P261-P280-P305 + P351 + P338-P342 + P311

H302-H312-H315-H319-H332-H334-H335

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P285, P301+P312, P302+P352, P304+P312, P304+P340, P304+P341, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P342+P311, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:209.07
XLogP3:3.2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:1
Exact Mass:208.99000443
Monoisotopic Mass:208.99000443
Topological Polar Surface Area:29.4
Heavy Atom Count:14
Complexity:241
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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