CAS Registry Number: 264916-06-5

Name:

2H-​Isoindole-​2-​carboxylic acid, 5-​amino-​1,​3-​dihydro-​, 1,​1-​dimethylethyl ester
5-​Amino-​1,​3-​dihydro-​2H-​isoindole-​2-​carboxylic acid tert-​butyl ester; 5-​Amino-​1,​3-​dihydroisoindole-​2-​carboxylic acid tert-​butyl ester; 5-​Amino-​2-​(tert-​butoxycarbonyl)​isoindoline; 5-​Aminoisoindoline-​2-​carboxylic acid tert-​butyl ester; tert-​Butyl 5-​aminoisoindoline-​2-​carboxylate 

Chemical Formula: C13H18N2O2
Exact Mass: 234.14
Molecular Weight: 234.29
m/z: 234.14 (100.0%), 235.14 (14.3%), 236.14 (1.4%)

InChI: InChI=1S/C13H18N2O2/c1-13(2,3)17-12(16)15-7-9-4-5-11(14)6-10(9)8-15/h4-6H,7-8,14H2,1-3H3
InChIKey: WJFWIRWHYIDBAQ-UHFFFAOYSA-N
Canonical SMILES : CC(C)(C)OC(=O)N1CC2=C(C1)C=C(C=C2)N

Specification

98%

PCT Int. Appl. (2013), WO 2013170774 A1 20131121.                                  

PCT Int. Appl. (2013), WO 2013059485 A1 20130425.