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CAS Number: 1374572-89-0
2-(1-oxo-1,3-dihydroisobenzofuran-5-yl)acetic acid

Structure

2-(1-oxo-1,3-dihydroisobenzofuran-5-yl)acetic acid
Name: 2-(1-oxo-1,3-dihydroisobenzofuran-5-yl)acetic acid
Synonyms:
General Information
Product Number: 1374572890

CAS Registry Number 1374572-89-0
Name:
5-​Isobenzofuranacetic acid, 1,​3-​dihydro-​1-​oxo-

 

Chemical Formula: C10H8O4
Exact Mass: 192.04
Molecular Weight: 192.17
m/z: 192.04 (100.0%), 193.05 (11.1%), 194.05 (1.4%)

 

InChI:InChI=1S/C10H8O4/c11-9(12)4-6-1-2-8-7(3-6)5-14-10(8)13/h1-3H,4-5H2,(H,11,12)

InChI Key:GXAUULHGSGMZND-UHFFFAOYSA-N

Canonical SMILES:C1C2=C(C=CC(=C2)CC(=O)O)C(=O)O1

Specification

98%

References

PCT Int. Appl. (2014), WO 2014099633 A2 20140626.

PCT Int. Appl. (2013), WO 2013039802 A1 20130321.

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