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Details

Stereochemistry ACHIRAL
Molecular Formula C8H8O4
Molecular Weight 168.1467
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL COUMALATE

SMILES

CCOC(=O)C1=COC(=O)C=C1

InChI

InChIKey=HXIHISRWARGVBG-UHFFFAOYSA-N
InChI=1S/C8H8O4/c1-2-11-8(10)6-3-4-7(9)12-5-6/h3-5H,2H2,1H3

HIDE SMILES / InChI

Molecular Formula C8H8O4
Molecular Weight 168.1467
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 21:39:55 GMT 2025
Edited
by admin
on Mon Mar 31 21:39:55 GMT 2025
Record UNII
M89WUK45OA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-407490
Preferred Name English
ETHYL COUMALATE
Common Name English
COUMALIC ACID, ETHYL ESTER
Common Name English
2H-PYRAN-5-CARBOXYLIC ACID, 2-OXO-, ETHYL ESTER
Common Name English
COUMALIC ACID ETHYL ESTER [MI]
Common Name English
Code System Code Type Description
NSC
407490
Created by admin on Mon Mar 31 21:39:55 GMT 2025 , Edited by admin on Mon Mar 31 21:39:55 GMT 2025
PRIMARY
CAS
5942-96-1
Created by admin on Mon Mar 31 21:39:55 GMT 2025 , Edited by admin on Mon Mar 31 21:39:55 GMT 2025
PRIMARY
EPA CompTox
DTXSID50208150
Created by admin on Mon Mar 31 21:39:55 GMT 2025 , Edited by admin on Mon Mar 31 21:39:55 GMT 2025
PRIMARY
FDA UNII
M89WUK45OA
Created by admin on Mon Mar 31 21:39:55 GMT 2025 , Edited by admin on Mon Mar 31 21:39:55 GMT 2025
PRIMARY
MERCK INDEX
m3815
Created by admin on Mon Mar 31 21:39:55 GMT 2025 , Edited by admin on Mon Mar 31 21:39:55 GMT 2025
PRIMARY Merck Index
PUBCHEM
348254
Created by admin on Mon Mar 31 21:39:55 GMT 2025 , Edited by admin on Mon Mar 31 21:39:55 GMT 2025
PRIMARY