2-Methyl-2-Propanyl (3-Aminopropyl)[4-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}[3-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)Propyl]Amino)Butyl]Carbamate
[CAS# 114459-62-0]

Identification

• Name: 2-Methyl-2-Propanyl (3-Aminopropyl)[4-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}[3-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)Propyl]Amino)Butyl]Carbamate
• Synonyms: {4-[(3-Amino-propyl)-tert-butoxycarbonyl-amino]-butyl}-(3-tert-butoxycarbonylamino-propyl)-carbamic acid tert-butyl ester; Spermine(HBBB)
• Molecular Formula: C₂₅H₅₀N₄O₆
• Molecular Weight: 502.69
• CAS Registry Number: 114459-62-0
• SMILES: O=C(OC(C)(C)C)N(CCCN)CCCCN(C(=O)OC(C)(C)C)CCCNC(=O)OC(C)(C)C
• InChI: 1S/C25H50N4O6/c1-23(2,3)33-20(30)27-15-13-19-29(22(32)35-25(7,8)9)17-11-10-16-28(18-12-14-26)21(31)34-24(4,5)6/h10-19,26H2,1-9H3,(H,27,30)
• InChIKey: XDUPBDDDCRDPGX-UHFFFAOYSA-N

Properties

• Density: 1.05g/cm³ (Cal.)
• Boiling point: 595.077°C at 760 mmHg (Cal.)
• Flash point: 313.691°C (Cal.)
• Refractive index: 1.487 (Cal.)