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CAS Number: 66938-02-1
isoindoline-1-carboxylic acid

Structure

isoindoline-1-carboxylic acid
Name: isoindoline-1-carboxylic acid
Synonyms:
General Information
Product Number: 66938021
CAS Registry Number: 66938-02-1
Name:
        1H-​Isoindole-​1-​carboxylic acid, 2,​3-​dihydro-
        Isoindoline-​1-​carboxylic acid 
 
Chemical Formula: C9H9NO2
Exact Mass: 163.06
Molecular Weight: 163.17
m/z: 163.06 (100.0%), 164.07 (9.9%)
Elemental Analysis: C, 66.25; H, 5.56; N, 8.58; O, 19.61
 
InChI: InChI=1S/C9H9NO2/c11-9(12)8-7-4-2-1-3-6(7)5-10-8/h1-4,8,10H,5H2,(H,11,12)
InChIKey: OFKFBEJYOHXPIA-UHFFFAOYSA-N
Canonical SMILES : C1C2=CC=CC=C2C(N1)C(=O)O

Specification

98%

References

PCT Int. Appl. (2012), WO 2012039717 A1 20120329.

PCT Int. Appl. (2012), WO 2012021591 A1 20120216.                                 

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