N-(3-Phenyl-2-propynoyl)-L-alanine
[CAS# 778563-97-6]

Identification

• Name: N-(3-Phenyl-2-propynoyl)-L-alanine
• Synonyms: (S)-2-(3-phenylpropiolamido)propanoic acid
• Molecular Formula: C₁₂H₁₁NO₃
• Molecular Weight: 217.22
• CAS Registry Number: 778563-97-6
• SMILES: C[C@@H](C(=O)O)NC(=O)C#Cc1ccccc1
• InChI: 1S/C12H11NO3/c1-9(12(15)16)13-11(14)8-7-10-5-3-2-4-6-10/h2-6,9H,1H3,(H,13,14)(H,15,16)/t9-/m0/s1
• InChIKey: YEQVXEFKUFWYOJ-VIFPVBQESA-N

Properties

• Density: 1.263g/cm³ (Cal.)
• Refractive index: 1.588 (Cal.)