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Benzothiophene-2-carbonitrile

Benzothiophene-2-carbonitrile structure

Benzothiophene-2-carbonitrile 

structure
  • CAS No:

    55219-11-9

  • Formula:

    C9H5NS

  • Chemical Name:

    Benzothiophene-2-carbonitrile

  • Synonyms:

    2-Cyanobenzothiophene;benzothiophene-2-carbonitrile;Benzo[b]thiophene-2-carbonitrile;2-Cyanobenzothiophene,Thianaphthene-2-carbonitrile;1-benzothiophene-2-carbonitrile

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

Benzothiophene-2-carbonitrile Basic Attributes

159.21

159.01400

DTXSID3073555

2934999090

Characteristics

52

3

1.28g/cm3

24-28 °C

140 °C/0.5 mmHg

110 °C

1.68

Safety Information

3

22-36

26

Xn

P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, P501

H302

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Benzothiophene-2-carbonitrile Use and Manufacturing

It can be used as the starting material for benzothiophene chemical reaction.

Computed Properties

Molecular Weight:159.21
XLogP3:3
Hydrogen Bond Acceptor Count:2
Exact Mass:159.01427034
Monoisotopic Mass:159.01427034
Topological Polar Surface Area:52
Heavy Atom Count:11
Complexity:193
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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