(2S)-2-Amino-3-Hydroxy-3-[4-Hydroxy-3-(3-Methylbut-2-Enyl)Phenyl]Propanoic Acid
[CAS# 151928-40-4]

Identification

• Name: (2S)-2-Amino-3-Hydroxy-3-[4-Hydroxy-3-(3-Methylbut-2-Enyl)Phenyl]Propanoic Acid
• Synonyms: (2S)-2-Amino-3-Hydroxy-3-[4-Hydroxy-3-(3-Methylbut-2-Enyl)Phenyl]Propionic Acid; 3-Prenyl-Beta-Hydroxytyrosine
• Molecular Formula: C₁₄H₁₉NO₄
• Molecular Weight: 265.31
• CAS Registry Number: 151928-40-4
• SMILES: [C@H](N)(C(O)C1=CC(=C(O)C=C1)CC=C(C)C)C(=O)O
• InChI: 1S/C14H19NO4/c1-8(2)3-4-9-7-10(5-6-11(9)16)13(17)12(15)14(18)19/h3,5-7,12-13,16-17H,4,15H2,1-2H3,(H,18,19)/t12-,13?/m0/s1
• InChIKey: KTMOYLSEGZRFNV-UEWDXFNNSA-N

Properties

• Density: 1.264g/cm³ (Cal.)
• Boiling point: 492.632°C at 760 mmHg (Cal.)
• Flash point: 251.735°C (Cal.)