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4-BROMO-3-NITROBENZONITRILE

4-BROMO-3-NITROBENZONITRILE structure

CAS No:
89642-49-9
Formula:
C7H3BrN2O2
Chemical Name:
4-BROMO-3-NITROBENZONITRILE
Synonyms:
4-BROMO-3-NITROBENZONITRILE;2-Bromo-5-cyanonitrobenzene;3-nitro-4-broMobenzonitrile;Benzonitrile, 4-bromo-3-nitro-
Categories:
Organic Chemistry > Hydrocarbons and Derivatives

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4-BROMO-3-NITROBENZONITRILE Basic Attributes

Molecular Weight：

227.01

Exact Mass：

225.937775

DSSTox ID：

DTXSID70398007

HScode：

2926909090

Characteristics

PSA：

69.6

XLogP3：

2.2

Density：

1.8±0.1 g/cm3

Melting Point：

116-120 °C

Boiling Point：

269℃

Flash Point：

116℃

Refractive Index：

1.639

Storage Conditions：

2-8°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

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+H312+H332

GHS Classification：

|Warning|H302+H312+H332 (25%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|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 4 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

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

Material

Ethyl acetate

Sodium bicarbonate

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4-BROMO-3-NITROBENZONITRILE

CAS No.: 89642-49-9

Content: 99.00%

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4-BROMO-3-NITROBENZONITRILE

CAS No.: 89642-49-9

Grade: Industrial Grade

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Guide of 4-BROMO-3-NITROBENZONITRILE

Basic Attributes
Characteristics
Safety Information
Computed Properties
Material
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