CHEBI:9662 - triacetylene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name triacetylene
ChEBI ID CHEBI:9662
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C6H2
Net Charge 0
Average Mass 74.08008
Monoisotopic Mass 74.01565
InChI InChI=1S/C6H2/c1-3-5-6-4-2/h1-2H
InChIKey MZHROOGPARRVHS-UHFFFAOYSA-N
SMILES C#CC#CC#C
ChEBI Ontology
Outgoing triacetylene (CHEBI:9662) is a alkatriyne (CHEBI:33652)
triacetylene (CHEBI:9662) is a terminal acetylenic compound (CHEBI:73477)
IUPAC Name
hexa-1,3,5-triyne
Synonyms Sources
1,3,5-Hexatriyne KEGG COMPOUND
HC≡C‒C≡C‒C≡CH IUPAC
HC≡CC≡CC≡CH NIST Chemistry WebBook
Triacetylene KEGG COMPOUND
Manual Xrefs Databases
C00001297 KNApSAcK
C08463 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
1731000 Beilstein Registry Number Beilstein
277863 Gmelin Registry Number Gmelin
3161-99-7 CAS Registry Number NIST Chemistry WebBook
Last Modified
28 July 2014