2-Methyl-2-Propanyl (E)-N⁵-(Amino{[(2,2,5,7,8-Pentamethyl-3,4-Dihydro-2H-Chromen-6-Yl)Sulfonyl]Amino}Methylene)-L-Ornithinate
[CAS# 169543-81-1]

Identification

• Name: 2-Methyl-2-Propanyl (E)-N⁵-(Amino{[(2,2,5,7,8-Pentamethyl-3,4-Dihydro-2H-Chromen-6-Yl)Sulfonyl]Amino}Methylene)-L-Ornithinate
• Synonyms: Nω-(2,2,5,7,8-Pentamethylchroman-6-sulfonyl)-L-arginine t-butyl ester
• Molecular Formula: C₂₄H₄₀N₄O₅S
• Molecular Weight: 496.66
• CAS Registry Number: 169543-81-1
• SMILES: O=C(OC(C)(C)C)[C@@H](N)CCC/N=C(\N)NS(=O)(=O)c2c(c(c1OC(CCc1c2C)(C)C)C)C
• InChI: 1S/C24H40N4O5S/c1-14-15(2)20(16(3)17-11-12-24(7,8)32-19(14)17)34(30,31)28-22(26)27-13-9-10-18(25)21(29)33-23(4,5)6/h18H,9-13,25H2,1-8H3,(H3,26,27,28)/t18-/m0/s1
• InChIKey: RYYVRFAJTNFQBC-SFHVURJKSA-N

Properties

• Density: 1.245g/cm³ (Cal.)
• Boiling point: 624.645°C at 760 mmHg (Cal.)
• Flash point: 331.574°C (Cal.)
• Refractive index: 1.571 (Cal.)