(1S,2S,4R)-7-{[(2-Methyl-2-propanyl)oxy]carbonyl}-7-azabicyclo[2.2.1]heptane-2-carboxylic acid
[CAS# 918411-46-8]

Identification

• Name: (1S,2S,4R)-7-{[(2-Methyl-2-propanyl)oxy]carbonyl}-7-azabicyclo[2.2.1]heptane-2-carboxylic acid
• Synonyms: "(1S,2S,4R)-7-(tert-butoxycarbonyl)-7-azabicyclo[2.2.1]heptane-2-carboxylic acid"; (1S,2S,4R)-7-(TERT-BUTOXYCARBONYL)-7-AZABICYCLO[2.2.1]HEPTANE-2-CARBOXYLICACID; (1S,2S,4R)-7-N-Boc-7-azabicyclo[2.2.1]heptane-2-carboxylic acid
• Molecular Formula: C₁₂H₁₉NO₄
• Molecular Weight: 241.28
• CAS Registry Number: 918411-46-8
• SMILES: CC(C)(C)OC(=O)N1[C@@H]2CC[C@H]1[C@H](C2)C(=O)O
• InChI: 1S/C12H19NO4/c1-12(2,3)17-11(16)13-7-4-5-9(13)8(6-7)10(14)15/h7-9H,4-6H2,1-3H3,(H,14,15)/t7-,8+,9+/m1/s1
• InChIKey: XRDRXGVDCVQVPV-VGMNWLOBSA-N

Properties

• Density: 1.233g/cm³ (Cal.)
• Boiling point: 371.004°C at 760 mmHg (Cal.)
• Flash point: 178.177°C (Cal.)
• Refractive index: 1.527 (Cal.)