Summary

IMPPAT Phytochemical identifier: IMPHY015620

Phytochemical name: Dimethyl carbonate

Synonymous chemical names:
dimethyl carbonate

External chemical identifiers:
CID:12021, ChEMBL:CHEMBL3185216, ChEBI:36596, ZINC:ZINC000001699944, FDASRS:KE9J097SPN, SureChEMBL:SCHEMBL20796, MolPort-003-931-791

---

Chemical structure information

SMILES:
COC(=O)OC

InChI:
InChI=1S/C3H6O3/c1-5-3(4)6-2/h1-2H3

InChIKey:
IEJIGPNLZYLLBP-UHFFFAOYSA-N

DeepSMILES:
COC=O)OC

Functional groups:
COC(=O)OC

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic acids and derivatives

ClassyFire Class: Organic carbonic acids and derivatives

ClassyFire Subclass: Carbonic acid diesters

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty esters

NP Classifier Class: Wax monoesters

NP-Likeness score: 0.175

---

Chemical structure download