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1-CYANO-2-BROMO-5-NITROBENZENE

1-CYANO-2-BROMO-5-NITROBENZENE structure

CAS No:
134604-07-2
Formula:
C7H3BrN2O2
Chemical Name:
1-CYANO-2-BROMO-5-NITROBENZENE
Synonyms:
2-BROMO-5-NITROBENZONITRILE;1-CYANO-2-BROMO-5-NITROBENZENE;2-Bromo-1-cyano-5-nitrobenzene;2-Bromo-5-nitrobenzonitrile 98%;2-BroMo-5-nitrobenzonitrile;Bromo-5-nitrobenzonitrile
Categories:
Organic Chemistry > Hydrocarbons and Derivatives

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Description

Type of white crystal

1-CYANO-2-BROMO-5-NITROBENZENE Basic Attributes

Molecular Weight：

227.01

Exact Mass：

225.937775

DSSTox ID：

DTXSID60427754

HScode：

29269090

Characteristics

PSA：

69.6

XLogP3：

2.2

Density：

1.81±0.1 g/cm3(Predicted)

Melting Point：

118-120 °C

Boiling Point：

321.1±32.0 °C(Predicted)

Flash Point：

148.0±25.1 °C

Refractive Index：

1.639

Storage Conditions：

2-8°C

Vapor Pressure：

0.000304mmHg at 25°C

Safety Information

Packing level：

Ⅲ

Hazard category：

6.1

Transport codes：

2811

wgk germany：

hazard class code：

22-36/37/38

safety instructions：

26-36/37-60

Marks：

Hazard note：

Irritant

Precautionary statement(s)：

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

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:227.01
XLogP3:2.2
Hydrogen Bond Acceptor Count:3
Exact Mass:225.93779
Monoisotopic Mass:225.93779
Topological Polar Surface Area:69.6
Heavy Atom Count:12
Complexity:229
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-CYANO-2-BROMO-5-NITROBENZENE

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
Latest News
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