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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 pentylmalonate

SMILES

CCCCCC(C(=O)OCC)C(=O)OCC

InChI

InChIKey=OQFYXOBMUBGANU-UHFFFAOYSA-N
InChI=1S/C12H22O4/c1-4-7-8-9-10(11(13)15-5-2)12(14)16-6-3/h10H,4-9H2,1-3H3

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 Sat Dec 16 12:29:58 GMT 2023
Edited
by admin
on Sat Dec 16 12:29:58 GMT 2023
Record UNII
2Z9BTV2J5Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Diethyl pentylmalonate
Systematic Name English
Propanedioic acid, 2-pentyl-, 1,3-diethyl ester
Systematic Name English
1,3-Diethyl 2-pentylpropanedioate
Systematic Name English
Malonic acid, pentyl-, diethyl ester
Systematic Name English
Diethyl 2-pentylmalonate
Systematic Name English
Propanedioic acid, pentyl-, diethyl ester
Systematic Name English
NSC-30682
Code English
2-Pentylmalonic acid diethyl ester
Systematic Name English
Code System Code Type Description
PUBCHEM
80167
Created by admin on Sat Dec 16 12:29:58 GMT 2023 , Edited by admin on Sat Dec 16 12:29:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID50209460
Created by admin on Sat Dec 16 12:29:58 GMT 2023 , Edited by admin on Sat Dec 16 12:29:58 GMT 2023
PRIMARY
NSC
30682
Created by admin on Sat Dec 16 12:29:58 GMT 2023 , Edited by admin on Sat Dec 16 12:29:58 GMT 2023
PRIMARY
CAS
6065-59-4
Created by admin on Sat Dec 16 12:29:58 GMT 2023 , Edited by admin on Sat Dec 16 12:29:58 GMT 2023
PRIMARY
ECHA (EC/EINECS)
227-997-7
Created by admin on Sat Dec 16 12:29:58 GMT 2023 , Edited by admin on Sat Dec 16 12:29:58 GMT 2023
PRIMARY
FDA UNII
2Z9BTV2J5Z
Created by admin on Sat Dec 16 12:29:58 GMT 2023 , Edited by admin on Sat Dec 16 12:29:58 GMT 2023
PRIMARY