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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H11ClO4
Molecular Weight 194.613
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIETHYL CHLOROMALONATE

SMILES

CCOC(=O)C(Cl)C(=O)OCC

InChI

InChIKey=WLWCQKMQYZFTDR-UHFFFAOYSA-N
InChI=1S/C7H11ClO4/c1-3-11-6(9)5(8)7(10)12-4-2/h5H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C7H11ClO4
Molecular Weight 194.613
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:14:27 GMT 2025
Edited
by admin
on Mon Mar 31 22:14:27 GMT 2025
Record UNII
8Y5J45M964
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIETHYL CHLOROMALONATE
Systematic Name English
NSC-227952
Preferred Name English
PROPANEDIOIC ACID, 2-CHLORO-, 1,3-DIETHYL ESTER
Systematic Name English
DIETHYL MONOCHLOROMALONATE
Systematic Name English
MALONIC ACID, CHLORO-, DIETHYL ESTER
Systematic Name English
DIETHYL CHLOROPROPANEDIOATE
Systematic Name English
CHLOROPROPANEDIOIC ACID ETHYL ESTER
Systematic Name English
CHLOROMALONIC ACID DIETHYL ESTER
Systematic Name English
ETHYL CHLOROMALONATE
Systematic Name English
PROPANEDIOIC ACID, CHLORO-, DIETHYL ESTER
Systematic Name English
DIETHYL 2-CHLOROMALONATE
Systematic Name English
.ALPHA.-CHLORODIETHYL MALONATE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID2022258
Created by admin on Mon Mar 31 22:14:27 GMT 2025 , Edited by admin on Mon Mar 31 22:14:27 GMT 2025
PRIMARY
NSC
227952
Created by admin on Mon Mar 31 22:14:27 GMT 2025 , Edited by admin on Mon Mar 31 22:14:27 GMT 2025
PRIMARY
FDA UNII
8Y5J45M964
Created by admin on Mon Mar 31 22:14:27 GMT 2025 , Edited by admin on Mon Mar 31 22:14:27 GMT 2025
PRIMARY
CAS
14064-10-9
Created by admin on Mon Mar 31 22:14:27 GMT 2025 , Edited by admin on Mon Mar 31 22:14:27 GMT 2025
PRIMARY
ECHA (EC/EINECS)
237-913-0
Created by admin on Mon Mar 31 22:14:27 GMT 2025 , Edited by admin on Mon Mar 31 22:14:27 GMT 2025
PRIMARY
PUBCHEM
84182
Created by admin on Mon Mar 31 22:14:27 GMT 2025 , Edited by admin on Mon Mar 31 22:14:27 GMT 2025
PRIMARY