(4R)-1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-[4-(trifluoromethyl)benzyl]-L-proline
[CAS# 957311-17-0]

Identification

• Name: (4R)-1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-[4-(trifluoromethyl)benzyl]-L-proline
• Synonyms: (2S,4R)-1-(tert-Butoxycarbonyl)-4-(4-(trifluoromethyl)benzyl)pyrrolidine-2-carboxylic acid; (2S,4R)-1-(tert-Butoxycarbonyl)-4-(4-(trifluoromethyl)-benzyl)pyrrolidine-2-carboxylic acid; Boc-(R)-4-[4-(trifluoromethyl)benzyl]-L-proline
• Molecular Formula: C₁₈H₂₂F₃NO₄
• Molecular Weight: 373.37
• CAS Registry Number: 957311-17-0
• SMILES: CC(C)(C)OC(=O)N1C[C@@H](C[C@H]1C(=O)O)CC2=CC=C(C=C2)C(F)(F)F
• InChI: 1S/C18H22F3NO4/c1-17(2,3)26-16(25)22-10-12(9-14(22)15(23)24)8-11-4-6-13(7-5-11)18(19,20)21/h4-7,12,14H,8-10H2,1-3H3,(H,23,24)/t12-,14+/m1/s1
• InChIKey: RQLCPQMSGLKHNN-OCCSQVGLSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 454.3±45.0°C at 760 mmHg (Cal.)
• Flash point: 228.5±28.7°C (Cal.)
• Refractive index: 1.51 (Cal.)

Safety Data

• Safety Description: CAUTION: May irritate eyes, skin, and respiratory tract