2-Methyl-2-propanyl (3R,4S)-3-{[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]carbonyl}-4-methylhexanoate
[CAS# 692778-49-7]

Identification

• Name: 2-Methyl-2-propanyl (3R,4S)-3-{[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]carbonyl}-4-methylhexanoate
• Synonyms: 3R-(4R-Benzyl-2-oxo-oxazolidine-3-carbonyl)-; 4S-methyl-hexanoic acid tert-butyl ester; 3R-(4R-Benzyl-2-oxo-oxazolidine-3-carbonyl)-4S-methyl-hexanoic acid tert-butyl ester
• Molecular Formula: C₂₂H₃₁NO₅
• Molecular Weight: 389.49
• CAS Registry Number: 692778-49-7
• SMILES: CC[C@H](C)[C@@H](CC(=O)OC(C)(C)C)C(=O)N1[C@@H](COC1=O)CC2=CC=CC=C2
• InChI: 1S/C22H31NO5/c1-6-15(2)18(13-19(24)28-22(3,4)5)20(25)23-17(14-27-21(23)26)12-16-10-8-7-9-11-16/h7-11,15,17-18H,6,12-14H2,1-5H3/t15-,17+,18+/m0/s1
• InChIKey: RCEHOHBPJZEWPH-CGTJXYLNSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 519.8±33.0°C at 760 mmHg (Cal.)
• Flash point: 268.2±25.4°C (Cal.)
• Refractive index: 1.521 (Cal.)