1-Adamantylaspartate
[CAS# 115545-59-0]

Identification

• Name: 1-Adamantylaspartate
• Synonyms: (2S)-4-(1-Adamantyloxy)-2-Amino-4-Oxo-Butanoic Acid; (2S)-4-(1-Adamantyloxy)-2-Amino-4-Keto-Butyric Acid; 1-Adamantylaspartate
• Molecular Formula: C₁₄H₂₁NO₄
• Molecular Weight: 267.32
• CAS Registry Number: 115545-59-0
• SMILES: [C@H](CC(OC13CC2CC(C1)CC(C2)C3)=O)(C(=O)O)N
• InChI: 1S/C14H21NO4/c15-11(13(17)18)4-12(16)19-14-5-8-1-9(6-14)3-10(2-8)7-14/h8-11H,1-7,15H2,(H,17,18)/t8?,9?,10?,11-,14?/m0/s1
• InChIKey: JWPBQLVAJXYMGD-RLFZITJJSA-N

Properties

• Density: 1.288g/cm³ (Cal.)
• Boiling point: 439.759°C at 760 mmHg (Cal.)
• Flash point: 219.759°C (Cal.)