U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C7H12O4
Molecular Weight 160.1678
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Dimethyl ethylmalonate

SMILES

CCC(C(=O)OC)C(=O)OC

InChI

InChIKey=XGRMVENQJLQMLT-UHFFFAOYSA-N
InChI=1S/C7H12O4/c1-4-5(6(8)10-2)7(9)11-3/h5H,4H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C7H12O4
Molecular Weight 160.1678
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:01:14 GMT 2023
Edited
by admin
on Sat Dec 16 12:01:14 GMT 2023
Record UNII
5WVV6D2TKP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Dimethyl ethylmalonate
Systematic Name English
Propanedioic acid, 2-ethyl-, 1,3-dimethyl ester
Systematic Name English
1,3-Dimethyl 2-ethylpropanedioate
Systematic Name English
Code System Code Type Description
CAS
26717-67-9
Created by admin on Sat Dec 16 12:01:14 GMT 2023 , Edited by admin on Sat Dec 16 12:01:14 GMT 2023
PRIMARY
EPA CompTox
DTXSID70181214
Created by admin on Sat Dec 16 12:01:14 GMT 2023 , Edited by admin on Sat Dec 16 12:01:14 GMT 2023
PRIMARY
PUBCHEM
117844
Created by admin on Sat Dec 16 12:01:14 GMT 2023 , Edited by admin on Sat Dec 16 12:01:14 GMT 2023
PRIMARY
FDA UNII
5WVV6D2TKP
Created by admin on Sat Dec 16 12:01:14 GMT 2023 , Edited by admin on Sat Dec 16 12:01:14 GMT 2023
PRIMARY
ECHA (EC/EINECS)
247-914-8
Created by admin on Sat Dec 16 12:01:14 GMT 2023 , Edited by admin on Sat Dec 16 12:01:14 GMT 2023
PRIMARY