2-Methyl-2-Propanyl [(trans-4-Cyanocyclohexyl)Methyl]Carbamate
[CAS# 473923-79-4]

Identification

• Name: 2-Methyl-2-Propanyl [(trans-4-Cyanocyclohexyl)Methyl]Carbamate
• Synonyms: tert-Butyl ((trans-4-cyanocyclohexyl)methyl)carbamate; trans-(4-Cyano-cyclohexylmethyl)-carbamic acid tert-butyl ester; trans-4-N-Boc-Aminomethyl-cyclohexanecarbonitrile
• Molecular Formula: C₁₃H₂₂N₂O₂
• Molecular Weight: 238.33
• CAS Registry Number: 473923-79-4
• SMILES: CC(OC(=O)NC[C@H]1CC[C@@H](CC1)C#N)(C)C
• InChI: 1S/C13H22N2O2/c1-13(2,3)17-12(16)15-9-11-6-4-10(8-14)5-7-11/h10-11H,4-7,9H2,1-3H3,(H,15,16)/t10-,11-
• InChIKey: KOFJDBKWKCOOLP-XYPYZODXSA-N

Properties

• Density: 1.032g/cm³ (Cal.)
• Boiling point: 383.999°C at 760 mmHg (Cal.)
• Flash point: 186.036°C (Cal.)
• Refractive index: 1.48 (Cal.)