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Home > Encyclopedia > 3 4 5-TRIMETHOXYBENZYL ISOCYANATE97

3 4 5-TRIMETHOXYBENZYL ISOCYANATE97

3 4 5-TRIMETHOXYBENZYL ISOCYANATE97 structure

3 4 5-TRIMETHOXYBENZYL ISOCYANATE97 

structure
  • CAS No:

    351003-01-5

  • Formula:

    C11H13NO4

  • Chemical Name:

    3 4 5-TRIMETHOXYBENZYL ISOCYANATE97

  • Synonyms:

    3 4 5-TRIMETHOXYBENZYL ISOCYANATE97

  • Categories:

    Analytical Chemistry  >  Standard

3 4 5-TRIMETHOXYBENZYL ISOCYANATE97 Basic Attributes

223.227

223.084

DTXSID20409293

Characteristics

57.1

2.2

1.11±0.1 g/cm3(Predicted)

84-88 °C(lit.)

Safety Information

3

20/21/22-36/37/38-42

22-26-36/37

Xn

P261, P264, P270, P271, P272, P280, P285, P301+P312, P302+P352, P304+P312, P304+P340, P304+P341, P305+P351+P338, P312, P321, P322, P330, P332+P313, P333+P313, P337+P313, P342+P311, P362, P363, P403+P233, P405, P501

H302

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P272, P280, P285, P301+P312, P302+P352, P304+P312, P304+P340, P304+P341, P305+P351+P338, P312, P321, P322, P330, P332+P313, P333+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:223.22
XLogP3:2.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:223.08445790
Monoisotopic Mass:223.08445790
Topological Polar Surface Area:57.1
Heavy Atom Count:16
Complexity:238
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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