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Home > Encyclopedia > 5-BROMO-2-ETHOXY-BENZONITRILE

5-BROMO-2-ETHOXY-BENZONITRILE

5-BROMO-2-ETHOXY-BENZONITRILE structure

5-BROMO-2-ETHOXY-BENZONITRILE 

structure
  • CAS No:

    279263-03-5

  • Formula:

    C9H8BrNO

  • Chemical Name:

    5-BROMO-2-ETHOXY-BENZONITRILE

  • Synonyms:

    5-bromo-2-ethoxybenzonitrile;Benzonitrile, 5-bromo-2-ethoxy-;5-bromo-2-ethoxybenzenecarbonitrile;ACMC-1CKSX;SCHEMBL392560;BEN167;BEN329;Benzonitrile,5-bromo-2-ethoxy-;CTK4G0483;DTXSID20361185

5-BROMO-2-ETHOXY-BENZONITRILE Basic Attributes

226.07

224.97900

DTXSID20361185

2926909090

Characteristics

33

2.71948

1.48g/cm3

82-84℃

301.5ºC at 760mmHg

136.2ºC

1.571

Safety Information

III

6.1

UN3439

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

H302

|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 5 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:226.07
XLogP3:2.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:224.97893
Monoisotopic Mass:224.97893
Topological Polar Surface Area:33
Heavy Atom Count:12
Complexity:186
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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