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CAS Number: 658683-13-7
isoindoline-4-carboxylic acid

Structure

isoindoline-4-carboxylic acid
Name: isoindoline-4-carboxylic acid
Synonyms:
General Information
Product Number: 658683137
CAS Registry Number: 658683-13-7
Name:
1H-​Isoindole-​4-​carboxylic acid, 2,​3-​dihydro-
 
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)7-3-1-2-6-4-10-5-8(6)7/h1-3,10H,4-5H2,(H,11,12)
InChIKey: YEJJKVAYXOGIIA-UHFFFAOYSA-N
Canonical SMILES : C1C2=CC=CC(=C2CN1)C(=O)O

Specification

98%

References

PCT Int. Appl. (2004), WO 2004014357 A2 20040219.

U.S. Pat. Appl. Publ. (2011), US 20110124705 A1 20110526.

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