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Home > Encyclopedia > 4,4′,4′′-Triphenylmethane triisocyanate

4,4′,4′′-Triphenylmethane triisocyanate

4,4′,4′′-Triphenylmethane triisocyanate structure

4,4′,4′′-Triphenylmethane triisocyanate 

structure
  • CAS No:

    2422-91-5

  • Formula:

    C22H13N3O3

  • Chemical Name:

    4,4′,4′′-Triphenylmethane triisocyanate

  • Synonyms:

    Benzene,1,1′,1′′-methylidynetris[4-isocyanato-;Isocyanic acid,methylidynetri-p-phenylene ester;Methane,tris(p-isocyanatophenyl)-;1,1′,1′′-Methylidynetris[4-isocyanatobenzene];4,4′,4′′-Triphenylmethane triisocyanate;Tris(4-isocyanatophenyl)methane;Tris(p-isocyanatophenyl)methane;4,4′,4′′-Triisocyanatotriphenylmethane;Methylidynetri-p-phenylene isocyanate;Triphenylmethane-4,4′,4′′-triyl triisocyanate;TTI;JQ 1;1-[Bis(4-isocyanatophenyl)methyl]-4-isocyanatobenzene

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

4,4′,4′′-Triphenylmethane triisocyanate Basic Attributes

367.35700

367.36

219-351-8

DTXSID7062401

2929109000

Characteristics

88.29000

4.76870

1.19g/cm3

265 °C @ Press: 1.0-1.2 Torr

204.7ºC

1.621

Safety Information

II

6.1(a)

UN 2206

P260, P261, P264, P270, P271, P272, P280, P284, P285, P301+P312, P302+P352, P304+P340, P304+P341, P305+P351+P338, P310, P312, P320, P321, P330, P332+P313, P333+P313, P337+P313, P342+P311, P362, P363, P403+P233, P405, P501

H302

|Danger|H302 (55.81%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P261, P264, P270, P271, P272, P280, P284, P285, P301+P312, P302+P352, P304+P340, P304+P341, P305+P351+P338, P310, P312, P320, P321, P330, P332+P313, P333+P313, P337+P313, P342+P311, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 43 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

4,4′,4′′-Triphenylmethane triisocyanate Use and Manufacturing

Benzene, 1,1',1''-methylidynetris[4-isocyanato-: ACTIVE

Computed Properties

Molecular Weight:367.4
XLogP3:7.7
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:367.09569129
Monoisotopic Mass:367.09569129
Topological Polar Surface Area:88.3
Heavy Atom Count:28
Complexity:548
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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