(2R)-2-Amino-3-[1,3-Benzodioxol-5-Yl-Di(Phenyl)Methyl]Sulfanylpropanoic Acid
[CAS# 35959-94-5]

Identification

• Name: (2R)-2-Amino-3-[1,3-Benzodioxol-5-Yl-Di(Phenyl)Methyl]Sulfanylpropanoic Acid
• Synonyms: (2R)-2-Amino-3-[1,3-Benzodioxol-5-Yl-Di(Phenyl)Methyl]Sulfanyl-Propanoic Acid; (2R)-2-Amino-3-[[1,3-Benzodioxol-5-Yl-Di(Phenyl)Methyl]Thio]Propanoic Acid; (2R)-2-Amino-3-[[1,3-Benzodioxol-5-Yl-Di(Phenyl)Methyl]Thio]Propionic Acid
• Molecular Formula: C₂₃H₂₁NO₄S
• Molecular Weight: 407.48
• CAS Registry Number: 35959-94-5
• SMILES: [C@H](CSC(C1=CC2=C(C=C1)OCO2)(C3=CC=CC=C3)C4=CC=CC=C4)(C(O)=O)N
• InChI: 1S/C23H21NO4S/c24-19(22(25)26)14-29-23(16-7-3-1-4-8-16,17-9-5-2-6-10-17)18-11-12-20-21(13-18)28-15-27-20/h1-13,19H,14-15,24H2,(H,25,26)/t19-/m0/s1
• InChIKey: GOAVOFCRODIGFE-IBGZPJMESA-N

Properties

• Density: 1.331g/cm³ (Cal.)
• Boiling point: 570.984°C at 760 mmHg (Cal.)
• Flash point: 299.12°C (Cal.)