EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:37821 - hexa-1,5-diyne

ChEBI IDCHEBI:37821
ChEBI Namehexa-1,5-diyne
Stars
Last Modified2 May 2013
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC6H6
Net Charge0
Average Mass78.114
Monoisotopic Mass78.04695
SMILESC#CCCC#C
InChIInChI=1S/C6H6/c1-3-5-6-4-2/h1-2H,5-6H2
InChIKeyYFIBSNDOVCWPBL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
hexa-1,5-diyne (CHEBI:37821) is a alkadiyne (CHEBI:33651)
hexa-1,5-diyne (CHEBI:37821) is a terminal acetylenic compound (CHEBI:73477)
IUPAC Name 
hexa-1,5-diyne
Synonyms  Source
BipropargylChemIDplus
DipropargylChemIDplus
1,5-HexadiyneChemIDplus
HC≡CCH2CH2C≡CHNIST Chemistry WebBook
Registry NumbersSources
Beilstein:505961Beilstein
CAS:628-16-0ChemIDplus
CAS:628-16-0NIST Chemistry WebBook