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CHEBI:17181 - 5-(4-acetoxybut-1-ynyl)-2,2'-bithiophene

Default Structure
ChEBI IDCHEBI:17181
ChEBI Name5-(4-acetoxybut-1-ynyl)-2,2'-bithiophene
Stars
Secondary ChEBI IDsCHEBI:2018, CHEBI:12090, CHEBI:20526
Last Modified13 November 2017
DownloadsMolfile
FormulaC14H12O2S2
Net Charge0
Average Mass276.382
Monoisotopic Mass276.02787
SMILESCC(=O)OCCC#Cc1ccc(-c2cccs2)s1
InChIInChI=1S/C14H12O2S2/c1-11(15)16-9-3-2-5-12-7-8-14(18-12)13-6-4-10-17-13/h4,6-8,10H,3,9H2,1H3
InChIKeyKHPAKGUGOFYJNA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-(4-acetoxybut-1-ynyl)-2,2'-bithiophene (CHEBI:17181) is a 2,2'-bithiophenes (CHEBI:19281)
IUPAC Name 
4-(2,2'-bithien-5-yl)but-3-yn-1-yl acetate
Synonyms  Source
4-(5-(2-thienyl)-2-thienyl)-3-butyn-1-ol acetateChemIDplus
5-(4-Acetoxybut-1-ynyl)-2,2'-bithiopheneKEGG COMPOUND
UniProt Name  Source
5-(4-acetoxybut-1-ynyl)-2,2'-bithiopheneUniProt
Manual XrefsDatabases
C04485KEGG COMPOUND
Registry NumbersSources
Beilstein:1288732Beilstein
CAS:1219-28-9ChemIDplus