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1,2,4-trichloro-5-isocyanatobenzene

1,2,4-trichloro-5-isocyanatobenzene structure

CAS No:
26328-35-8
Formula:
C7H2Cl3NO
Chemical Name:
1,2,4-trichloro-5-isocyanatobenzene
Synonyms:
2,4,5-Trichlorophenyl isocyanate; 2,4,5-Trichlor-phenylisocyanat;

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1,2,4-trichloro-5-isocyanatobenzene Basic Attributes

Molecular Weight：

222.45600

Exact Mass：

220.920197

DSSTox ID：

DTXSID40407993

HScode：

2929109000

Characteristics

PSA：

29.43000

XLogP3：

3.61410

Density：

1.51g/cm3

Melting Point：

55-61ºC

Boiling Point：

286.5ºC

Flash Point：

113.6ºC

Refractive Index：

1.597

Vapor Pressure：

0.00263mmHg at 25°C

Safety Information

hazard class code：

R23/25; R36/37/38; R42

safety instructions：

S22-S26-S36/37/39-S45

Marks：

GHS Classification：

|Warning|H302 (97.44%): 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 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:222.5
XLogP3:4.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:220.920197
Monoisotopic Mass:220.920197
Topological Polar Surface Area:29.4
Heavy Atom Count:12
Complexity:205
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,2,4-trichloro-5-isocyanatobenzene

Basic Attributes
Characteristics
Safety Information
Computed Properties

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