CHEBI:167414 - 2,3,5-Trimethoxytoluene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2,3,5-Trimethoxytoluene
ChEBI ID CHEBI:167414
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H14O3
Net Charge 0
Average Mass 182.219
Monoisotopic Mass 182.09429
InChI InChI=1S/C10H14O3/c1-7-5-8(11-2)6-9(12-3)10(7)13-4/h5-6H,1-4H3
InChIKey HLFDEAPOXFIBPC-UHFFFAOYSA-N
SMILES O(C=1C(=CC(OC)=CC1OC)C)C
ChEBI Ontology
Outgoing 2,3,5-Trimethoxytoluene (CHEBI:167414) is a methoxybenzenes (CHEBI:51683)
IUPAC Name
1,2,5-trimethoxy-3-methylbenzene
Manual Xref Database
148754 ChemSpider
View more database links
Registry Number Type Source
38790-14-6 CAS Registry Number ChemIDplus