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phenylacetonitrile
A nitrile that is acetonitrile where one of the methyl hydrogens is substituted by a phenyl group.


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03. Biological Effects of Specific Chemicals: molecular messenger [CHEBI:33280] > semiochemical [CHEBI:26645]
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03. Biological Effects of Specific Chemicals 
03. Biological Effects of Specific Chemicals
 molecular messenger [CHEBI:33280] (92) 
 semiochemical [CHEBI:26645] (10) 
 pheromone [CHEBI:26013] (8) 
 phenylacetonitrile [CHEBI:25979] (1)
04. Bioactive Capabilities of Specific Chemicals  
04. Bioactive Capabilities of Specific Chemicals
 Lyases [EC:4] (743) 
 Other lyases [EC:4.99] (10) 
 Sole sub-subclass for lyases that do not belong in the other subclasses [EC:4.99.1] (10) 
 Phenylacetaldoxime dehydratase [EC:4.99.1.7] (2) 
 phenylacetonitrile [CHEBI:25979] (1)
08. Chemical Category 
08. Chemical Category
 main group molecular entity [CHEBI:33579] (25650) 
 p-block molecular entity [CHEBI:33675] (25343) 
 pnictogen molecular entity [CHEBI:33302] (10027) 
 nitrogen molecular entity [CHEBI:51143] (7930) 
 organonitrogen compound [CHEBI:35352] (6705) 
 cyanides [CHEBI:23424] (120) 
 nitrile [CHEBI:18379] (117) 
 phenylacetonitrile [CHEBI:25979] (1)
 carbon group molecular entity [CHEBI:33582] (23847) 
 organic molecular entity [CHEBI:50860] (23769) 
 heteroorganic entity [CHEBI:33285] (15197) 
 organonitrogen compound [CHEBI:35352] (6705) 
 cyanides [CHEBI:23424] (120) 
 nitrile [CHEBI:18379] (117) 
 phenylacetonitrile [CHEBI:25979] (1)
ChEBI Compound Accession Identifier  [CHEBI:25979]
ChEBI Compound Description  A nitrile that is acetonitrile where one of the methyl hydrogens is substituted by a phenyl group.
ChEBI Compound Identification Number  25979
ChEBI InChI Value  InChI=1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2
ChEBI InChIKey Value  SUSQOBVLVYHIEX-UHFFFAOYSA-N
ChEBI Compound Name  phenylacetonitrile
ChEBI SMILES Value  N#CCc1ccccc1
ChEBI Substance ID  11533426
ChEBI URL  ChEBI:25979
ChemSpider ID  13839308
Ontomatica Chemical Accession Key (OnChAKey)  SUSQOBVLVYHIEX_UHFFFAOYSA_N_000_000000
PubChem Compound ID  8794