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Home > Encyclopedia > 2-isocyanato-2,4,4-trimethylpentane

2-isocyanato-2,4,4-trimethylpentane

2-isocyanato-2,4,4-trimethylpentane structure

2-isocyanato-2,4,4-trimethylpentane 

structure
  • CAS No:

    1611-57-0

  • Formula:

    C9H17NO

  • Chemical Name:

    2-isocyanato-2,4,4-trimethylpentane

  • Synonyms:

    1611-57-0;1,1,3,3-Tetramethylbutyl isocyanate;tert-Octyl isocyanate;2-isocyanato-2,4,4-trimethylpentane;Pentane, 2-isocyanato-2,4,4-trimethyl-;2-isocyanato-2,4,4-trimethyl-pentane;MFCD00209615;TERT-OCTYLISOCYANATE;NSC6402;ACMC-1BNST;SCHEMBL1394370;DTXSID70328187;NSC-6402;ZINC1693448;AKOS009159124;MCULE-3200882826;1,1,3,3-Tetramethylbutyl isocyanate, 98%;FT-0691718;J-009792

2-isocyanato-2,4,4-trimethylpentane Basic Attributes

155.24 g/mol

155.131014166 g/mol

6402

DTXSID70328187

Characteristics

29.4 Ų

Safety Information

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P312, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 42 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:155.24
XLogP3:3.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:155.131014166
Monoisotopic Mass:155.131014166
Topological Polar Surface Area:29.4
Heavy Atom Count:11
Complexity:171
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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