2-Methyl-2-propanyl 5-[2-(isopropylamino)-1,3-thiazol-4-yl]-1,3-dihydro-2H-isoindole-2-carboxylate
[CAS# 850877-62-2]

Identification

• Name: 2-Methyl-2-propanyl 5-[2-(isopropylamino)-1,3-thiazol-4-yl]-1,3-dihydro-2H-isoindole-2-carboxylate
• Synonyms: 2-Boc-5-(2-Isopropylamino-thiazol-4-yl)-isoindoline; 5-(2-Isopropylamino-thiazol-4-yl)-1,3-dihydro-isoindole-2-carboxylic acid tert-butyl ester
• Molecular Formula: C₁₉H₂₅N₃O₂S
• Molecular Weight: 359.49
• CAS Registry Number: 850877-62-2
• SMILES: CC(C)Nc1nc(cs1)c2ccc3c(c2)CN(C3)C(=O)OC(C)(C)C
• InChI: 1S/C19H25N3O2S/c1-12(2)20-17-21-16(11-25-17)13-6-7-14-9-22(10-15(14)8-13)18(23)24-19(3,4)5/h6-8,11-12H,9-10H2,1-5H3,(H,20,21)
• InChIKey: SGADKXWKLBWHHU-UHFFFAOYSA-N

Properties

• Density: 1.208g/cm³ (Cal.)
• Boiling point: 490.027°C at 760 mmHg (Cal.)
• Flash point: 250.159°C (Cal.)
• Refractive index: 1.602 (Cal.)