2-Methyl-2-Propanyl [(2S,4E)-1-Oxo-4-Hexen-2-Yl]Carbamate
[CAS# 208521-98-6]

Identification

• Name: 2-Methyl-2-Propanyl [(2S,4E)-1-Oxo-4-Hexen-2-Yl]Carbamate
• Synonyms: ((S)-1-Formyl-pent-3-enyl)-carbamic acid tert-butyl ester; (S,E)-tert-butyl (1-oxohex-4-en-2-yl)carbamate; tert-butyl N-[(2S,4E)-1-oxohex-4-en-2-yl]carbamate
• Molecular Formula: C₁₁H₁₉NO₃
• Molecular Weight: 213.27
• CAS Registry Number: 208521-98-6
• SMILES: C/C=C/C[C@@H](C=O)NC(=O)OC(C)(C)C
• InChI: 1S/C11H19NO3/c1-5-6-7-9(8-13)12-10(14)15-11(2,3)4/h5-6,8-9H,7H2,1-4H3,(H,12,14)/b6-5+/t9-/m0/s1
• InChIKey: RSBUTZZRCGSLFK-CYNONHLPSA-N

Properties

• Density: 1.0±0.1g/cm³ (Cal.)
• Boiling point: 306.3±35.0°C at 760 mmHg (Cal.)
• Flash point: 139.0±25.9°C (Cal.)
• Refractive index: 1.46 (Cal.)