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2-CHLORO-4-NITROPHENYLISOCYANATE

2-CHLORO-4-NITROPHENYLISOCYANATE structure

CAS No:
40397-95-3
Formula:
C7H3ClN2O3
Chemical Name:
2-CHLORO-4-NITROPHENYLISOCYANATE
Synonyms:
2-Chloro-4-nitrophenyl isocyanate;2-chloro-4-nitrophenylisocyanate;2-chloro-1-isocyanato-4-nitrobenzene;ACMC-1AMA4;SCHEMBL1513945;2-chloro-4-nitrobenzenisocyanate;CTK4I2995;DTXSID80404901;ZINC4978062;MFCD00037063

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2-CHLORO-4-NITROPHENYLISOCYANATE Basic Attributes

Molecular Weight：

198.56300

Exact Mass：

197.98300

DSSTox ID：

DTXSID80404901

HScode：

2929109000

Characteristics

PSA：

75.25000

XLogP3：

2.73870

Density：

1.48g/cm3

Melting Point：

59-63ºC(lit.)

Boiling Point：

291.8ºC at 760 mmHg

Flash Point：

130.3ºC

Refractive Index：

1.612

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

UN 2206 6.1/PG 3

wgk germany：

hazard class code：

R23/24/25;R36/37/38;R42

safety instructions：

S22-S26-S36/37/39-S45

Marks：

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P310, 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：

H301

Computed Properties

Molecular Weight:198.56
XLogP3:3.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:197.9832197
Monoisotopic Mass:197.9832197
Topological Polar Surface Area:75.2
Heavy Atom Count:13
Complexity:247
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-CHLORO-4-NITROPHENYLISOCYANATE

Basic Attributes
Characteristics
Safety Information
Computed Properties

2-CHLORO-4-NITROPHENYLISOCYANATE

SDS

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