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Details

Stereochemistry ACHIRAL
Molecular Formula C10H8O2
Molecular Weight 160.1693
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3-Ethylidenephthalide

SMILES

CC=C1OC(=O)C2=CC=CC=C12

InChI

InChIKey=FLOWXWKOKRXGBR-MBXJOHMKSA-N
InChI=1S/C10H8O2/c1-2-9-7-5-3-4-6-8(7)10(11)12-9/h2-6H,1H3/b9-2-

HIDE SMILES / InChI

Molecular Formula C10H8O2
Molecular Weight 160.1693
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 21:02:40 GMT 2025
Edited
by admin
on Wed Apr 02 21:02:40 GMT 2025
Record UNII
DE3G2PC4GX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-508400
Preferred Name English
3-Ethylidenephthalide
Common Name English
1(3H)-Isobenzofuranone, 3-ethylidene
Systematic Name English
3-Ethylidene-1(3H)-isobenzofuranone
Systematic Name English
Code System Code Type Description
CAS
61658-90-0
Created by admin on Wed Apr 02 21:02:40 GMT 2025 , Edited by admin on Wed Apr 02 21:02:40 GMT 2025
PRIMARY
EPA CompTox
DTXSID50358861
Created by admin on Wed Apr 02 21:02:40 GMT 2025 , Edited by admin on Wed Apr 02 21:02:40 GMT 2025
PRIMARY
FDA UNII
DE3G2PC4GX
Created by admin on Wed Apr 02 21:02:40 GMT 2025 , Edited by admin on Wed Apr 02 21:02:40 GMT 2025
PRIMARY
PUBCHEM
350182
Created by admin on Wed Apr 02 21:02:40 GMT 2025 , Edited by admin on Wed Apr 02 21:02:40 GMT 2025
PRIMARY