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

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-(4-acetoxybut-1-ynyl)-2,2'-bithiophene
ChEBI ID CHEBI:17181
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:12090, CHEBI:2018, CHEBI:20526
Supplier Information
Download Molfile XML SDF
Formula C14H12O2S2
Net Charge 0
Average Mass 276.37588
Monoisotopic Mass 276.028
InChI InChI=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
InChIKey KHPAKGUGOFYJNA-UHFFFAOYSA-N
SMILES CC(=O)OCCC#Cc1ccc(s1)-c1cccs1
ChEBI Ontology
Outgoing 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 Sources
4-(5-(2-thienyl)-2-thienyl)-3-butyn-1-ol acetate ChemIDplus
5-(4-Acetoxybut-1-ynyl)-2,2'-bithiophene KEGG COMPOUND
5-(4-acetoxybut-1-ynyl)-2,2'-bithiophene UniProt
Manual Xref Database
C04485 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
1219-28-9 CAS Registry Number ChemIDplus
1288732 Beilstein Registry Number Beilstein
Last Modified
13 November 2017