CAS Registry Number: 398491-59-3

Name:

Pyrrolo[3,​4-​c]​pyrazole-​5(1H)​-​carboxylic acid, 3-​amino-​4,​6-​dihydro-​, 1,​1-​dimethylethyl ester
3-​Amino-​4,​6-​dihydro-​1H-​pyrrolo[3,​4-​c]​pyrazole-​5-​carboxylic acid tert-​butyl ester; 3-​Amino-​5-​(tert-​butoxycarbonyl)​-​4,​6-​dihydro-​1H-​pyrrolo[3,​4-​c]​pyrazole; tert-​Butyl 3-​amino-​4,​6-​dihydropyrrolo[3,​4-​c]​pyrazole-​5(1H)​-​carboxylate 

Chemical Formula: C10H16N4O2
Exact Mass: 224.13
Molecular Weight: 224.26
m/z: 224.13 (100.0%), 225.13 (11.1%), 225.12 (1.5%), 226.13 (1.1%)

InChI: InChI=1S/C10H16N4O2/c1-10(2,3)16-9(15)14-4-6-7(5-14)12-13-8(6)11/h4-5H2,1-3H3,(H3,11,12,13)
InChIKey: BEVRTOCHMXNPLY-UHFFFAOYSA-N
Canonical SMILES : CC(C)(C)OC(=O)N1CC2=C(C1)NN=C2N

Specification

98%

1. (1) Fancelli, Daniele; Journal of Medicinal Chemistry 2005, V48(8), P3080-3084 CAPLUS
2. (2) Shi, Jianyou; Bioorganic & Medicinal Chemistry Letters 2010, V20(14), P4273-4278 CAPLUS
3. (3) Krasavin, Mikhail; Letters in Organic Chemistry 2008, V5(7), P594-598 CAPLUS