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Details

Stereochemistry RACEMIC
Molecular Formula C14H26O4
Molecular Weight 258.3538
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIETHYL ETHYL(1-METHYLBUTYL)MALONATE

SMILES

CCCC(C)C(CC)(C(=O)OCC)C(=O)OCC

InChI

InChIKey=ZQGOJSLHZOKIBV-UHFFFAOYSA-N
InChI=1S/C14H26O4/c1-6-10-11(5)14(7-2,12(15)17-8-3)13(16)18-9-4/h11H,6-10H2,1-5H3

HIDE SMILES / InChI

Molecular Formula C14H26O4
Molecular Weight 258.3538
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:39:10 GMT 2025
Edited
by admin
on Mon Mar 31 23:39:10 GMT 2025
Record UNII
6LWT1P8JUR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIETHYL ETHYL(1-METHYLBUTYL)MALONATE
Systematic Name English
NSC-10824
Preferred Name English
PROPANEDIOIC ACID, 2-ETHYL-2-(1-METHYLBUTYL)-, 1,3-DIETHYL ESTER
Systematic Name English
MALONIC ACID, ETHYL(.ALPHA.-METHYLBUTYL)-, DIETHYL ESTER
Systematic Name English
MALONIC ACID, ETHYL(1-METHYLBUTYL)-, DIETHYL ESTER
Systematic Name English
PROPANEDIOIC ACID, ETHYL(1-METHYLBUTYL)-, DIETHYL ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
6LWT1P8JUR
Created by admin on Mon Mar 31 23:39:10 GMT 2025 , Edited by admin on Mon Mar 31 23:39:10 GMT 2025
PRIMARY
NSC
10824
Created by admin on Mon Mar 31 23:39:10 GMT 2025 , Edited by admin on Mon Mar 31 23:39:10 GMT 2025
PRIMARY
CAS
76-72-2
Created by admin on Mon Mar 31 23:39:10 GMT 2025 , Edited by admin on Mon Mar 31 23:39:10 GMT 2025
PRIMARY
EPA CompTox
DTXSID601018955
Created by admin on Mon Mar 31 23:39:10 GMT 2025 , Edited by admin on Mon Mar 31 23:39:10 GMT 2025
PRIMARY
PUBCHEM
95450
Created by admin on Mon Mar 31 23:39:10 GMT 2025 , Edited by admin on Mon Mar 31 23:39:10 GMT 2025
PRIMARY
ECHA (EC/EINECS)
200-981-7
Created by admin on Mon Mar 31 23:39:10 GMT 2025 , Edited by admin on Mon Mar 31 23:39:10 GMT 2025
PRIMARY