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Details

Stereochemistry ACHIRAL
Molecular Formula C9H14O5
Molecular Weight 202.2045
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIETHYL ACETONEDICARBOXYLATE

SMILES

CCOC(=O)CC(=O)CC(=O)OCC

InChI

InChIKey=ZSANYRMTSBBUCA-UHFFFAOYSA-N
InChI=1S/C9H14O5/c1-3-13-8(11)5-7(10)6-9(12)14-4-2/h3-6H2,1-2H3

HIDE SMILES / InChI
Molecular Formula C9H14O5
Molecular Weight 202.2045
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
149124
Substance Class Chemical
Created
by admin
on Tue Apr 01 19:07:23 GMT 2025
Edited
by admin
on Tue Apr 01 19:07:23 GMT 2025
Record UNII
Q0CC9NL00V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIETHYL ACETONEDICARBOXYLATE
Common Name English
NSC-9013
Preferred Name English
.BETA.-KETOGLUTARIC ACID DIETHYL ESTER
Systematic Name English
GLUTARIC ACID, 3-OXO-, DIETHYL ESTER
Systematic Name English
DIETHYL 3-OXOGLUTARATE
Systematic Name English
DIETHYL .BETA.-OXOGLUTARATE
Systematic Name English
DIETHYL .BETA.-KETOGLUTARATE
Systematic Name English
DIETHYL 2-OXOPROPANE-1,3-DICARBOXYLATE
Systematic Name English
DIETHYL 3-KETOGLUTARATE
Systematic Name English
3-OXOPENTANEDIOIC ACID DIETHYL ESTER
Systematic Name English
ACETONEDICARBOXYLIC ACID DIETHYL ESTER
Systematic Name English
1,3-ACETONEDICARBOXYLIC ACID DIETHYL ESTER
Systematic Name English
DIETHYL 1,3-ACETONEDICARBOXYLATE
Systematic Name English
DIETHYL 3-OXOPENTANEDIOATE
Systematic Name English
PENTANEDIOIC ACID, 3-OXO-, 1,5-DIETHYL ESTER
Systematic Name English
GLUTARIC ACID, .BETA.-OXO-, DIETHYL ESTER
Systematic Name English
PENTANEDIOIC ACID, 3-OXO-, DIETHYL ESTER
Common Name English
Code System Code Type Description
PUBCHEM
66045
Created by admin on Tue Apr 01 19:07:23 GMT 2025 , Edited by admin on Tue Apr 01 19:07:23 GMT 2025
PRIMARY
NSC
9013
Created by admin on Tue Apr 01 19:07:23 GMT 2025 , Edited by admin on Tue Apr 01 19:07:23 GMT 2025
PRIMARY
EPA CompTox
DTXSID1059317
Created by admin on Tue Apr 01 19:07:23 GMT 2025 , Edited by admin on Tue Apr 01 19:07:23 GMT 2025
PRIMARY
CAS
105-50-0
Created by admin on Tue Apr 01 19:07:23 GMT 2025 , Edited by admin on Tue Apr 01 19:07:23 GMT 2025
PRIMARY
ECHA (EC/EINECS)
203-302-2
Created by admin on Tue Apr 01 19:07:23 GMT 2025 , Edited by admin on Tue Apr 01 19:07:23 GMT 2025
PRIMARY
FDA UNII
Q0CC9NL00V
Created by admin on Tue Apr 01 19:07:23 GMT 2025 , Edited by admin on Tue Apr 01 19:07:23 GMT 2025
PRIMARY
NIH
NCATS
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