CHEBI:178404 - 1,1-dimethoxyethane

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ChEBI Name 1,1-dimethoxyethane
ChEBI ID CHEBI:178404
Definition An acetal that is dimethoxymethane substituted by a methyl group at position 1.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C4H10O2
Net Charge 0
Average Mass 90.122
Monoisotopic Mass 90.06808
InChI InChI=1S/C4H10O2/c1-4(5-2)6-3/h4H,1-3H3
InChIKey SPEUIVXLLWOEMJ-UHFFFAOYSA-N
SMILES COC(C)OC
Roles Classification
Biological Role(s): flavouring agent
A food additive that is used to added improve the taste or odour of a food.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Application(s): flavouring agent
A food additive that is used to added improve the taste or odour of a food.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1,1-dimethoxyethane (CHEBI:178404) has functional parent dimethoxymethane (CHEBI:48341)
1,1-dimethoxyethane (CHEBI:178404) has role flavouring agent (CHEBI:35617)
1,1-dimethoxyethane (CHEBI:178404) has role plant metabolite (CHEBI:76924)
1,1-dimethoxyethane (CHEBI:178404) is a acetal (CHEBI:59769)
1,1-dimethoxyethane (CHEBI:178404) is a diether (CHEBI:46786)
IUPAC Name
1,1-dimethoxyethane
Synonyms Sources
3-methyl-2,4-dioxapentane NIST Chemistry WebBook
acetaldehyde dimethyl acetal ChEBI
acetaldehyde methyl acetal NIST Chemistry WebBook
dimethyl acetal NIST Chemistry WebBook
ethylidene dimethyl ether NIST Chemistry WebBook
FEMA 3426 ChEBI
Manual Xrefs Databases
13854808 ChemSpider
C00053103 KNApSAcK
FDB001369 FooDB
HMDB0030061 HMDB
View more database links
Registry Numbers Types Sources
1697039 Reaxys Registry Number Reaxys
534-15-6 CAS Registry Number ChemIDplus
534-15-6 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
28644629 PubMed citation Europe PMC
3243762 PubMed citation Europe PMC
35193021 PubMed citation Europe PMC
Last Modified
20 December 2022