Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID016183

Phytochemical name: Ethylene glycol dimethacrylate

Synonymous chemical names:
ethylene methacrylate

External chemical identifiers:
CID:CID_7355, ChEMBL:CHEMBL1709582, ChEBI:CHEBI:53436, ZINC:ZINC000001608917, FDASRS:7BK5G69305, SureChEMBL:SCHEMBL15636, MolPort-003-925-348

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Chemical structure information

SMILES:
O=C(C(=C)C)OCCOC(=O)C(=C)C

InChI:
InChI=1S/C10H14O4/c1-7(2)9(11)13-5-6-14-10(12)8(3)4/h1,3,5-6H2,2,4H3

InChIKey:
STVZJERGLQHEKB-UHFFFAOYSA-N

DeepSMILES:
O=CC=C)C))OCCOC=O)C=C)C

Functional groups:
C=C(C)C(=O)OC

Link to spectral information:
MSBNK-Athens_Univ-AU500901, MSBNK-Athens_Univ-AU500902, MSBNK-EPA-ENTACT_AGILENT002426, MSBNK-EPA-ENTACT_AGILENT002427

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic acids and derivatives

ClassyFire Class: Carboxylic acids and derivatives

ClassyFire Subclass: Dicarboxylic acids and derivatives

NP Classifier Biosynthetic pathway: Fatty acids, Terpenoids

NP Classifier Superclass: Fatty esters

NP Classifier Class: Wax monoesters

NP-Likeness score: 0.265

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Chemical structure download