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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > sulfur oxoacid derivative > sulfonic acid derivative > 4-(methylsulfonyl)benzonitrile
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > sulfonic acid derivative > 4-(methylsulfonyl)benzonitrile

Preferred term

4-(methylsulfonyl)benzonitrile  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C8H7NO2S

inchi

  • InChI=1S/C8H7NO2S/c1-12(10,11)8-4-2-7(6-9)3-5-8/h2-5H,1H3

inchikey

  • FARXIDYHJAANGP-UHFFFAOYSA-N

mass

  • 181.210

monoisotopicmass

  • 181.01975

smiles

  • S(=O)(=O)(C1=CC=C(C=C1)C#N)C

subset

  • 2_STAR

synonym EXACT

  • 4-methylsulonylbenzonitrile

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:194962

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