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Details

Stereochemistry RACEMIC
Molecular Formula C10H8O5
Molecular Weight 208.1675
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Isoochracinic acid

SMILES

OC(=O)CC1OC(=O)C2=C(O)C=CC=C12

InChI

InChIKey=JUVHLXCMFDJFQF-UHFFFAOYSA-N
InChI=1S/C10H8O5/c11-6-3-1-2-5-7(4-8(12)13)15-10(14)9(5)6/h1-3,7,11H,4H2,(H,12,13)

HIDE SMILES / InChI

Molecular Formula C10H8O5
Molecular Weight 208.1675
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:07:43 GMT 2025
Edited
by admin
on Mon Mar 31 21:07:43 GMT 2025
Record UNII
NG54CQS77K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOOCHRACINIC ACID-
Preferred Name English
Isoochracinic acid
Common Name English
1-Isobenzofuranacetic acid, 1,3-dihydro-4-hydroxy-3-oxo-
Systematic Name English
2-(4-HYDROXY-3-OXO-1H-ISOBENZOFURAN-1-YL)ACETIC ACID
Systematic Name English
ISOOCHRACINIC-ACID
Common Name English
1,3-Dihydro-4-hydroxy-3-oxoisobenzofuran-1-acetic acid
Systematic Name English
Code System Code Type Description
PUBCHEM
6455371
Created by admin on Mon Mar 31 21:07:43 GMT 2025 , Edited by admin on Mon Mar 31 21:07:43 GMT 2025
PRIMARY
FDA UNII
NG54CQS77K
Created by admin on Mon Mar 31 21:07:43 GMT 2025 , Edited by admin on Mon Mar 31 21:07:43 GMT 2025
PRIMARY
CAS
66964-78-1
Created by admin on Mon Mar 31 21:07:43 GMT 2025 , Edited by admin on Mon Mar 31 21:07:43 GMT 2025
PRIMARY