(2S)-2-[[(2S)-2-Amino-3-(4-Hydroxyphenyl)Propanoyl]Amino]-3-(4-Dimethylaminophenyl)Propanoic Acid
[CAS# 124985-59-7]

Identification

• Name: (2S)-2-[[(2S)-2-Amino-3-(4-Hydroxyphenyl)Propanoyl]Amino]-3-(4-Dimethylaminophenyl)Propanoic Acid
• Synonyms: (2S)-2-[[(2S)-2-Amino-3-(4-Hydroxyphenyl)-1-Oxopropyl]Amino]-3-(4-Dimethylaminophenyl)Propanoic Acid; (2S)-2-[[(2S)-2-Amino-3-(4-Hydroxyphenyl)Propanoyl]Amino]-3-(4-Dimethylaminophenyl)Propionic Acid; Tyr-Dm-Phe
• Molecular Formula: C₂₀H₂₅N₃O₄
• Molecular Weight: 371.44
• CAS Registry Number: 124985-59-7
• SMILES: [C@H](C(=O)O)(NC([C@@H](N)CC1=CC=C(O)C=C1)=O)CC2=CC=C(C=C2)N(C)C
• InChI: 1S/C20H25N3O4/c1-23(2)15-7-3-14(4-8-15)12-18(20(26)27)22-19(25)17(21)11-13-5-9-16(24)10-6-13/h3-10,17-18,24H,11-12,21H2,1-2H3,(H,22,25)(H,26,27)/t17-,18-/m0/s1
• InChIKey: WNJJVNYQIJOXFR-ROUUACIJSA-N

Properties

• Density: 1.279g/cm³ (Cal.)
• Boiling point: 677.33°C at 760 mmHg (Cal.)
• Flash point: 363.436°C (Cal.)