(2S)-1-[(2R)-2-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-2-phenylacetyl]-2-azetidinecarboxylic acid
[CAS# 866099-92-5]

Identification

• Name: (2S)-1-[(2R)-2-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-2-phenylacetyl]-2-azetidinecarboxylic acid
• Synonyms: (2S,2'R)-1-(2-N-Boc-Amino-2-phenyl-acetyl)-azetidine-2-carboxylic acid; (2S,2R)-1-(2-N-BOC-AMINO-2-PHENYL-ACETYL)-AZETIDINE-2-CARBOXYLICACID; (2S,2'R)-1-(2-tert-Butoxycarbonylamino-2-phenyl-acetyl)-azetidine-2-carboxylic acid
• Molecular Formula: C₁₇H₂₂N₂O₅
• Molecular Weight: 334.37
• CAS Registry Number: 866099-92-5
• SMILES: O=C(O)[C@H]2N(C(=O)[C@@H](c1ccccc1)NC(=O)OC(C)(C)C)CC2
• InChI: 1S/C17H22N2O5/c1-17(2,3)24-16(23)18-13(11-7-5-4-6-8-11)14(20)19-10-9-12(19)15(21)22/h4-8,12-13H,9-10H2,1-3H3,(H,18,23)(H,21,22)/t12-,13+/m0/s1
• InChIKey: MLYXECBASWFKBQ-QWHCGFSZSA-N

Properties

• Density: 1.277g/cm³ (Cal.)
• Boiling point: 568.076°C at 760 mmHg (Cal.)
• Flash point: 297.362°C (Cal.)
• Refractive index: 1.568 (Cal.)