N-(3,5-Dihydroxybenzoyl)-L-tyrosine
[CAS# 77354-66-6]

Identification

• Name: N-(3,5-Dihydroxybenzoyl)-L-tyrosine
• Synonyms: BENZOYL-3,5-DIHYDROXY-L-TYROSINE
• Molecular Formula: C₁₆H₁₅NO₆
• Molecular Weight: 317.29
• CAS Registry Number: 77354-66-6
• SMILES: C1=CC(=CC=C1C[C@@H](C(=O)O)NC(=O)C2=CC(=CC(=C2)O)O)O
• InChI: 1S/C16H15NO6/c18-11-3-1-9(2-4-11)5-14(16(22)23)17-15(21)10-6-12(19)8-13(20)7-10/h1-4,6-8,14,18-20H,5H2,(H,17,21)(H,22,23)/t14-/m0/s1
• InChIKey: ZJPJEQADILVXRS-AWEZNQCLSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 708.9±60.0°C at 760 mmHg (Cal.)
• Flash point: 382.5±32.9°C (Cal.)