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Home > Encyclopedia > 2-Methoxybenzylisocyanate

2-Methoxybenzylisocyanate

2-Methoxybenzylisocyanate structure

2-Methoxybenzylisocyanate 

structure
  • CAS No:

    93489-08-8

  • Formula:

    C9H9NO2

  • Chemical Name:

    2-Methoxybenzylisocyanate

  • Synonyms:

    2-Methoxybenzyl isocyanate;1-(isocyanatomethyl)-2-methoxybenzene;2-Methoxybenzylisocyanate;Benzene, 1-(isocyanatomethyl)-2-methoxy-;ACMC-20anrp;1-(isocyanatomethyl)-2-methoxy-benzene;Ortho-methoxybenzyl isocyanate;SCHEMBL1205405;CTK5H2585;DTXSID80404305

2-Methoxybenzylisocyanate Basic Attributes

163.17300

163.06300

DTXSID80404305

2929109000

Characteristics

38.66000

1.53100

1.06

231-232ºC

>230 °F

1.5285

Safety Information

UN 2206

3

R25;R36/37/38

S26-S36-S45

T: Toxic;

P261-P301 + P310-P305 + P351 + P338

H301-H315-H319-H335

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:163.17
XLogP3:2.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:163.063328530
Monoisotopic Mass:163.063328530
Topological Polar Surface Area:38.7
Heavy Atom Count:12
Complexity:175
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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