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CHEBI:79721 - Bisphenol A bis(2-hydroxypropyl) ether

Default Structure
ChEBI IDCHEBI:79721
ChEBI NameBisphenol A bis(2-hydroxypropyl) ether
Stars
DownloadsMolfile
FormulaC21H28O4
Net Charge0
Average Mass344.451
Monoisotopic Mass344.19876
SMILESCC(O)COc1ccc(C(C)(C)c2ccc(OCC(C)O)cc2)cc1
InChIInChI=1S/C21H28O4/c1-15(22)13-24-19-9-5-17(6-10-19)21(3,4)18-7-11-20(12-8-18)25-14-16(2)23/h5-12,15-16,22-23H,13-14H2,1-4H3
InChIKeyMIUUNYUUEFHIHM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Bisphenol A bis(2-hydroxypropyl) ether (CHEBI:79721) is a diarylmethane (CHEBI:51614)
Synonyms  Source
2,2-Bis[4-(2-hydroxy-2-methylethoxy)phenyl]propaneKEGG COMPOUND
Bisphenol A propoxylateKEGG COMPOUND
Manual XrefsDatabases
C15208KEGG COMPOUND
Registry NumbersSources
CAS:116-37-0KEGG COMPOUND