2-Methyl-2-Propanyl (3S)-3-Azepanylcarbamate
[CAS# 213990-48-8]

Identification

• Name: 2-Methyl-2-Propanyl (3S)-3-Azepanylcarbamate
• Synonyms: (S)-tert-Butyl azepan-3-ylcarbamate; Carbamic acid, [(3S)-hexahydro-1H-azepin-3-yl]-, 1,1-dimethylethyl ester (9CI)
• Molecular Formula: C₁₁H₂₂N₂O₂
• Molecular Weight: 214.30
• CAS Registry Number: 213990-48-8
• SMILES: O=C(OC(C)(C)C)N[C@H]1CCCCNC1
• InChI: 1S/C11H22N2O2/c1-11(2,3)15-10(14)13-9-6-4-5-7-12-8-9/h9,12H,4-8H2,1-3H3,(H,13,14)/t9-/m0/s1
• InChIKey: NZEPWAXJSWYEDV-VIFPVBQESA-N

Properties

• Density: 1.013g/cm³ (Cal.)
• Boiling point: 322.692°C at 760 mmHg (Cal.)
• Flash point: 148.959°C (Cal.)
• Refractive index: 1.48 (Cal.)