2-{[4-(Phenyldiazenyl)benzyl]sulfonyl}ethyl N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-seryl-S-(acetamidomethyl)-L-cysteinate
[CAS# 76408-56-5]

Identification

• Name: 2-{[4-(Phenyldiazenyl)benzyl]sulfonyl}ethyl N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-seryl-S-(acetamidomethyl)-L-cysteinate
• Synonyms: 2-[[4-(phenylazo)benzyl]sulphonyl]ethyl S-(acetamidomethyl)-N-[N-(tert-butoxycarbonyl)-L-seryl]-L-cysteinate
• Molecular Formula: C₂₉H₃₉N₅O₉S₂
• Molecular Weight: 665.78
• CAS Registry Number: 76408-56-5
• EINECS: 278-439-4
• SMILES: CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N[C@@H](CSCNC(C)=O)C(=O)OCCS(=O)(=O)Cc2ccc(N=Nc1ccccc1)cc2
• InChI: 1S/C29H39N5O9S2/c1-20(36)30-19-44-17-25(31-26(37)24(16-35)32-28(39)43-29(2,3)4)27(38)42-14-15-45(40,41)18-21-10-12-23(13-11-21)34-33-22-8-6-5-7-9-22/h5-13,24-25,35H,14-19H2,1-4H3,(H,30,36)(H,31,37)(H,32,39)/t24-,25-/m0/s1
• InChIKey: FUIQPFOXKWIACS-DQEYMECFSA-N

Properties

• Density: 1.329g/cm³ (Cal.)
• Boiling point: 967.028°C at 760 mmHg (Cal.)
• Flash point: 538.639°C (Cal.)