CHEBI:188626 - 2-Chlorobenzylidenemalononitrile

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2-Chlorobenzylidenemalononitrile
ChEBI ID CHEBI:188626
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H5ClN2
Net Charge 0
Average Mass 188.610
Monoisotopic Mass 188.01413
InChI InChI=1S/C10H5ClN2/c11-10-4-2-1-3-9(10)5-8(6-12)7-13/h1-5H
InChIKey JJNZXLAFIPKXIG-UHFFFAOYSA-N
SMILES ClC=1C(=CC=CC1)C=C(C#N)C#N
Metabolite of Species Details
Phyllostachys violascens (NCBI:txid1903417) Found in stem (BTO:0001300). of strain Phyllostachys violascens cv. Viridisulcata See: MetaboLights Study
ChEBI Ontology
Outgoing 2-Chlorobenzylidenemalononitrile (CHEBI:188626) is a organochlorine compound (CHEBI:36683)
IUPAC Name
2-[(2-chlorophenyl)methylidene]propanedinitrile
Manual Xref Database
16644 ChemSpider
View more database links
Registry Number Type Source
2698-41-1 CAS Registry Number ChemIDplus