skip to main content

Chemistry, part 1

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > isocyanates > 2-phenylethyl isocyanate
organooxygen compound > isocyanates > 2-phenylethyl isocyanate

Preferred term

2-phenylethyl isocyanate  

Type

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

Broader concept

charge

  • 0

formula

  • C9H9NO

has_role

inchi

  • InChI=1S/C9H9NO/c11-8-10-7-6-9-4-2-1-3-5-9/h1-5H,6-7H2

inchikey

  • HACRKYQRZABURO-UHFFFAOYSA-N

mass

  • 147.17390

monoisotopicmass

  • 147.06841

smiles

  • O=C=NCCc1ccccc1

subset

  • 3_STAR

synonym EXACT

  • (2-isocyanatoethyl)benzene

synonym RELATED

  • 2-Phenylethylisocyanate
  • phenethyl isocyanate
  • Phenylethyl isocyanate
  • Phenylethylisocyanate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:60067

Download this concept:

RDF/XML TURTLE JSON-LD