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Details

Stereochemistry ACHIRAL
Molecular Formula C12H22O4
Molecular Weight 230.3007
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIETHYL SUBERATE

SMILES

CCOC(=O)CCCCCCC(=O)OCC

InChI

InChIKey=PEUGOJXLBSIJQS-UHFFFAOYSA-N
InChI=1S/C12H22O4/c1-3-15-11(13)9-7-5-6-8-10-12(14)16-4-2/h3-10H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C12H22O4
Molecular Weight 230.3007
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 Tue Apr 01 19:07:20 GMT 2025
Edited
by admin
on Tue Apr 01 19:07:20 GMT 2025
Record UNII
XJ55KFM3S6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIETHYL SUBERATE
Systematic Name English
NSC-62701
Preferred Name English
DIETHYL OCTANEDIOATE
Common Name English
OCTANEDIOIC ACID, 1,8-DIETHYL ESTER
Systematic Name English
OCTANEDIOIC ACID, DIETHYL ESTER
Common Name English
SUBERIC ACID, DIETHYL ESTER
Common Name English
Code System Code Type Description
FDA UNII
XJ55KFM3S6
Created by admin on Tue Apr 01 19:07:20 GMT 2025 , Edited by admin on Tue Apr 01 19:07:20 GMT 2025
PRIMARY
CAS
2050-23-9
Created by admin on Tue Apr 01 19:07:20 GMT 2025 , Edited by admin on Tue Apr 01 19:07:20 GMT 2025
PRIMARY
ECHA (EC/EINECS)
218-084-4
Created by admin on Tue Apr 01 19:07:20 GMT 2025 , Edited by admin on Tue Apr 01 19:07:20 GMT 2025
PRIMARY
EPA CompTox
DTXSID90174486
Created by admin on Tue Apr 01 19:07:20 GMT 2025 , Edited by admin on Tue Apr 01 19:07:20 GMT 2025
PRIMARY
PUBCHEM
16301
Created by admin on Tue Apr 01 19:07:20 GMT 2025 , Edited by admin on Tue Apr 01 19:07:20 GMT 2025
PRIMARY
NSC
62701
Created by admin on Tue Apr 01 19:07:20 GMT 2025 , Edited by admin on Tue Apr 01 19:07:20 GMT 2025
PRIMARY