Phenylmethyl 2-[[2-[(2-Amino-4-Methylpentyl)Disulfanylmethyl]-3-Phenylpropanoyl]Amino]Acetate
[CAS# 135949-54-1]

Identification

• Name: Phenylmethyl 2-[[2-[(2-Amino-4-Methylpentyl)Disulfanylmethyl]-3-Phenylpropanoyl]Amino]Acetate
• Synonyms: Phenylmethyl 2-[[2-[(2-Amino-4-Methyl-Pentyl)Disulfanylmethyl]-3-Phenyl-Propanoyl]Amino]Acetate; 2-[[2-[(2-Amino-4-Methylpentyl)Disulfanylmethyl]-1-Oxo-3-Phenylpropyl]Amino]Acetic Acid Phenylmethyl Ester; 2-[[2-[(2-Amino-4-Methyl-Pentyl)Disulfanylmethyl]-3-Phenyl-Propanoyl]Amino]Acetic Acid Benzyl Ester
• Molecular Formula: C₂₅H₃₄N₂O₃S₂
• Molecular Weight: 474.68
• CAS Registry Number: 135949-54-1
• SMILES: C2=C(CC(C(=O)NCC(OCC1=CC=CC=C1)=O)CSSCC(N)CC(C)C)C=CC=C2
• InChI: 1S/C25H34N2O3S2/c1-19(2)13-23(26)18-32-31-17-22(14-20-9-5-3-6-10-20)25(29)27-15-24(28)30-16-21-11-7-4-8-12-21/h3-12,19,22-23H,13-18,26H2,1-2H3,(H,27,29)
• InChIKey: AOAAKTIWWOEKKS-UHFFFAOYSA-N

Properties

• Density: 1.167g/cm³ (Cal.)
• Boiling point: 640.565°C at 760 mmHg (Cal.)
• Flash point: 341.201°C (Cal.)