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1-Chloro-5-isocyanato-2,4-dimethoxybenzene

1-Chloro-5-isocyanato-2,4-dimethoxybenzene structure

CAS No:
55440-55-6
Formula:
C9H8ClNO3
Chemical Name:
1-Chloro-5-isocyanato-2,4-dimethoxybenzene
Synonyms:
Benzene,1-chloro-5-isocyanato-2,4-dimethoxy-;1-Chloro-5-isocyanato-2,4-dimethoxybenzene;5-Chloro-2,4-dimethoxyphenyl isocyanate

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1-Chloro-5-isocyanato-2,4-dimethoxybenzene Basic Attributes

Molecular Weight：

213.62

Exact Mass：

213.62

BRN：

2726949

DSSTox ID：

DTXSID10402753

HScode：

2929109000

Characteristics

PSA：

47.9

XLogP3：

2.32450

Density：

1.24g/cm3

Melting Point：

94-98 °C(lit.)

Boiling Point：

314.5ºC at 760 mmHg

Flash Point：

144ºC

Refractive Index：

1.522

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

2811

wgk germany：

hazard class code：

20/21/22-36/37/38

safety instructions：

26-36/37/39

Marks：

Xn,Xi

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 (100%): 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:213.62
XLogP3:3.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:213.0192708
Monoisotopic Mass:213.0192708
Topological Polar Surface Area:47.9
Heavy Atom Count:14
Complexity:230
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-Chloro-5-isocyanato-2,4-dimethoxybenzene

Basic Attributes
Characteristics
Safety Information
Computed Properties

1-Chloro-5-isocyanato-2,4-dimethoxybenzene

SDS

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