2-Adamantylaspartate
[CAS# 115545-60-3]

Identification

• Name: 2-Adamantylaspartate
• Synonyms: (2R)-4-(2-Adamantyloxy)-2-Amino-4-Oxo-Butanoic Acid; (2R)-4-(2-Adamantyloxy)-2-Amino-4-Keto-Butyric Acid; 2-Adamantylaspartate
• Molecular Formula: C₁₄H₂₁NO₄
• Molecular Weight: 267.32
• CAS Registry Number: 115545-60-3
• SMILES: [C@@H](CC(OC2C1CC3CC(C1)CC2C3)=O)(C(O)=O)N
• InChI: 1S/C14H21NO4/c15-11(14(17)18)6-12(16)19-13-9-2-7-1-8(4-9)5-10(13)3-7/h7-11,13H,1-6,15H2,(H,17,18)/t7?,8?,9?,10?,11-,13?/m1/s1
• InChIKey: WXDSZIVHWONVQR-JQUFPMINSA-N

Properties

• Density: 1.283g/cm³ (Cal.)
• Boiling point: 447.734°C at 760 mmHg (Cal.)
• Flash point: 224.581°C (Cal.)