2-Methyl-2-propanyl [(2S)-1-oxo-4-hexyn-2-yl]carbamate
[CAS# 666718-90-7]

Identification

• Name: 2-Methyl-2-propanyl [(2S)-1-oxo-4-hexyn-2-yl]carbamate
• Synonyms: ((S)-1-Formyl-pent-3-ynyl)-carbamic acid tert-butyl ester; (S)-tert-butyl (1-oxohex-4-yn-2-yl)carbamate
• Molecular Formula: C₁₁H₁₇NO₃
• Molecular Weight: 211.26
• CAS Registry Number: 666718-90-7
• SMILES: CC#CC[C@@H](C=O)NC(=O)OC(C)(C)C
• InChI: 1S/C11H17NO3/c1-5-6-7-9(8-13)12-10(14)15-11(2,3)4/h8-9H,7H2,1-4H3,(H,12,14)/t9-/m0/s1
• InChIKey: DHJDFHOSKBYZPS-VIFPVBQESA-N

Properties

• Density: 1.0±0.1g/cm³ (Cal.)
• Boiling point: 316.6±37.0°C at 760 mmHg (Cal.)
• Flash point: 145.3±26.5°C (Cal.)
• Refractive index: 1.467 (Cal.)