2-(Phenylalanylglycyl)Amino-3-(4-Nitrophenyl)-1,3-Propanediol
[CAS# 93359-23-0]

Identification

• Name: 2-(Phenylalanylglycyl)Amino-3-(4-Nitrophenyl)-1,3-Propanediol
• Synonyms: (2S)-2-Amino-N-[2-[[(1R,2R)-2-Hydroxy-1-(Hydroxymethyl)-2-(4-Nitrophenyl)Ethyl]Amino]Acetyl]-3-Phenyl-Propanamide; (2S)-2-Amino-N-[2-[[(1R,2R)-2-Hydroxy-1-(Hydroxymethyl)-2-(4-Nitrophenyl)Ethyl]Amino]-1-Oxoethyl]-3-Phenylpropanamide; (2S)-2-Amino-N-[2-[[(1R
• Molecular Formula: C₂₀H₂₄N₄O₆
• Molecular Weight: 416.43
• CAS Registry Number: 93359-23-0
• SMILES: [C@@H](O)(C1=CC=C([N+]([O-])=O)C=C1)[C@H](NCC(=O)NC(=O)[C@@H](N)CC2=CC=CC=C2)CO
• InChI: 1S/C20H24N4O6/c21-16(10-13-4-2-1-3-5-13)20(28)23-18(26)11-22-17(12-25)19(27)14-6-8-15(9-7-14)24(29)30/h1-9,16-17,19,22,25,27H,10-12,21H2,(H,23,26,28)/t16-,17+,19+/m0/s1
• InChIKey: WZEJGSYLAFXHCK-YQVWRLOYSA-N

Properties

• Density: 1.361g/cm³ (Cal.)
• Boiling point: 703.932°C at 760 mmHg (Cal.)
• Flash point: 379.524°C (Cal.)