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Details

Stereochemistry ACHIRAL
Molecular Formula C8H6O3
Molecular Weight 150.1314
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Hydroxy-1(3H)-isobenzofuranone

SMILES

OC1=C2COC(=O)C2=CC=C1

InChI

InChIKey=ZSCIMKFWMUXNBS-UHFFFAOYSA-N
InChI=1S/C8H6O3/c9-7-3-1-2-5-6(7)4-11-8(5)10/h1-3,9H,4H2

HIDE SMILES / InChI

Molecular Formula C8H6O3
Molecular Weight 150.1314
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 Wed Apr 02 07:12:11 GMT 2025
Edited
by admin
on Wed Apr 02 07:12:11 GMT 2025
Record UNII
RH7XK8BCC3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Hydroxy-1(3H)-isobenzofuranone
Systematic Name English
1(3H)-Isobenzofuranone, 4-hydroxy-
Preferred Name English
4-Oxidanyl-3H-2-benzofuran-1-one
Systematic Name English
Code System Code Type Description
FDA UNII
RH7XK8BCC3
Created by admin on Wed Apr 02 07:12:11 GMT 2025 , Edited by admin on Wed Apr 02 07:12:11 GMT 2025
PRIMARY
CAS
13161-32-5
Created by admin on Wed Apr 02 07:12:11 GMT 2025 , Edited by admin on Wed Apr 02 07:12:11 GMT 2025
PRIMARY
PUBCHEM
12662077
Created by admin on Wed Apr 02 07:12:11 GMT 2025 , Edited by admin on Wed Apr 02 07:12:11 GMT 2025
PRIMARY
EPA CompTox
DTXSID60506053
Created by admin on Wed Apr 02 07:12:11 GMT 2025 , Edited by admin on Wed Apr 02 07:12:11 GMT 2025
PRIMARY