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2-Amino-3-bromobenzonitrile

2-Amino-3-bromobenzonitrile structure

2-Amino-3-bromobenzonitrile 

structure
  • CAS No:

    114344-60-4

  • Formula:

    C7H5BrN2

  • Chemical Name:

    2-Amino-3-bromobenzonitrile

  • Synonyms:

    2-Amino-3-bromobenzonitrile;2-Bromo-6-cyanoaniline;3-BroMoanthranilonitrile;2-Bromo-6-cyanoaniline, 3-Bromoanthranilonitrile

2-Amino-3-bromobenzonitrile Basic Attributes

197.035

195.963608

DTXSID60404303

2926909090

Characteristics

49.8

2.2

Solid

1.68±0.1 g/cm3 (20 ºC 760 Torr)

119-120℃

289.5±25.0℃ (760 Torr)

128.9±23.2℃

1.652

0.0022mmHg at 25°C

Safety Information

Ⅲ

6.1

3439

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

H315

|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.

2-Amino-3-bromobenzonitrile Use and Manufacturing

The specific steps are as follows: adding acetophenone (0.5 mmol) to a 38 mL pressure-resistant tube. Iodine (0.8 mmol) and 2 mL of DMSO, after the first reaction at 100 C for 45 min (acetophenone completely disappeared), To the reaction solution was added

Computed Properties

Molecular Weight:197.03
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:195.96361
Monoisotopic Mass:195.96361
Topological Polar Surface Area:49.8
Heavy Atom Count:10
Complexity:160
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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