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4-TERT-BUTYLPHENYLISOCYANATE

4-TERT-BUTYLPHENYLISOCYANATE structure

CAS No:
1943-67-5
Formula:
C11H13NO
Chemical Name:
4-TERT-BUTYLPHENYLISOCYANATE
Synonyms:
4-(tert-Butyl)phenylisocyanate97%;1-TERT-BUTYL-4-ISOCYANATOBENZENE;4-TERT-BUTYLPHENYL ISOCYANATE;tert-Butylphenyl isocyanate;Benzene, 1-(1,1-dimethylethyl)-4-isocyanato-

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4-TERT-BUTYLPHENYLISOCYANATE Basic Attributes

Molecular Weight：

175.23

Exact Mass：

175.099714038

DSSTox ID：

DTXSID70370888

Characteristics

Density：

0.986 g/mL at 25 °C(lit.)

Boiling Point：

236-237 °C(lit.)

Refractive Index：

n20/D 1.5190(lit.)

Safety Information

Transport codes：

2206

wgk germany：

hazard class code：

20/21/22-36/37/38

safety instructions：

26-36

Marks：

Xn,T

GHS Classification：

|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 40 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:175.23
XLogP3:4.4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:175.099714038
Monoisotopic Mass:175.099714038
Topological Polar Surface Area:29.4
Heavy Atom Count:13
Complexity:203
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-TERT-BUTYLPHENYLISOCYANATE

Basic Attributes
Characteristics
Safety Information
Computed Properties

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