Tert-Butyl (2R)-2-[[(2S)-2-Formamido-4-Methylsulfanylbutanoyl]Amino]-3-Phenylpropanoate
[CAS# 117014-54-7]

Identification

• Name: Tert-Butyl (2R)-2-[[(2S)-2-Formamido-4-Methylsulfanylbutanoyl]Amino]-3-Phenylpropanoate
• Synonyms: Tert-Butyl (2R)-2-[[(2S)-2-Formamido-4-Methylsulfanyl-Butanoyl]Amino]-3-Phenyl-Propanoate; (2R)-2-[[(2S)-2-Formamido-4-(Methylthio)-1-Oxobutyl]Amino]-3-Phenylpropanoic Acid Tert-Butyl Ester; (2R)-2-[[(2S)-2-Formamido-4-(Methylthio)Butanoyl]Amino]-3-Phenyl-Propionic Acid Tert-Butyl Ester
• Molecular Formula: C₁₉H₂₈N₂O₄S
• Molecular Weight: 380.50
• CAS Registry Number: 117014-54-7
• SMILES: [C@@H](C(=O)OC(C)(C)C)(NC([C@@H](NC=O)CCSC)=O)CC1=CC=CC=C1
• InChI: 1S/C19H28N2O4S/c1-19(2,3)25-18(24)16(12-14-8-6-5-7-9-14)21-17(23)15(20-13-22)10-11-26-4/h5-9,13,15-16H,10-12H2,1-4H3,(H,20,22)(H,21,23)/t15-,16+/m0/s1
• InChIKey: VWGDVNIQTWNNGP-JKSUJKDBSA-N

Properties

• Density: 1.139g/cm³ (Cal.)
• Boiling point: 614.004°C at 760 mmHg (Cal.)
• Flash point: 325.138°C (Cal.)