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2-CHLORO-6-METHYLPHENYLISOCYANATE

2-CHLORO-6-METHYLPHENYLISOCYANATE structure

CAS No:
40398-01-4
Formula:
C8H6ClNO
Chemical Name:
2-CHLORO-6-METHYLPHENYLISOCYANATE
Synonyms:
6-CHLORO-2-METHYLPHENYLISOCYANATE;2-CHLORO-6-METHYLPHENYLISOCYANATE;2-Chloro-6-methylphenylisocyanate,97%;2-CHLORO-6-METHYLPHENYLISOCYANATE97%;2-Chloro-6-methylphenylisocyanate95+%
Categories:
Chemical Reagents > Organic Reagents

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Description

Clear colorless to slightly yellow liquid

2-CHLORO-6-METHYLPHENYLISOCYANATE Basic Attributes

Molecular Weight：

167.59

Exact Mass：

167.01400

BRN：

2690768

NSC Number：

108229

DSSTox ID：

DTXSID90296192

HScode：

2929109000

Characteristics

PSA：

29.4

XLogP3：

2.61570

Appearance：

colorless liquid

Density：

1.231 g/mL at 25 °C(lit.)

Boiling Point：

80 °C2 mm Hg(lit.)

Flash Point：

225 °F

Refractive Index：

n20/D 1.555(lit.)

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

UN 2206 6.1/PG 2

wgk germany：

hazard class code：

20/21/22-36/37/38

safety instructions：

26-36/37/39

Marks：

Xn,T,C

Hazard note：

Toxic/Corrosive/Lachrymatory/Moisture Sensitive

Precautionary statement(s)：

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

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (90.48%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, 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:167.59
XLogP3:3.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:167.0137915
Monoisotopic Mass:167.0137915
Topological Polar Surface Area:29.4
Heavy Atom Count:11
Complexity:177
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-CHLORO-6-METHYLPHENYLISOCYANATE

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
Latest News
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2-CHLORO-6-METHYLPHENYLISOCYANATE

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