Dibutoline
[CAS# 21962-82-3]

Identification

• Name: Dibutoline
• Synonyms: 2-(Dibutylcarbamoyloxy)Ethyl-Ethyl-Dimethyl-Ammonium Sulfate; 2-[(Dibutylamino)-Oxomethoxy]Ethyl-Ethyl-Dimethylammonium Sulfate; 2-(Dibutylcarbamoyloxy)Ethyl-Ethyl-Dimethyl-Azanium Sulfate
• Molecular Formula: C₃₀H₆₆N₄O₈S
• Molecular Weight: 642.93
• CAS Registry Number: 21962-82-3 (532-49-0)
• SMILES: C(N(C(OCC[N+](CC)(C)C)=O)CCCC)CCC.C(N(C(OCC[N+](CC)(C)C)=O)CCCC)CCC.O=[S](=O)([O-])[O-]
• InChI: 1S/2C15H33N2O2.H2O4S/c2*1-6-9-11-16(12-10-7-2)15(18)19-14-13-17(4,5)8-3;1-5(2,3)4/h2*6-14H2,1-5H3;(H2,1,2,3,4)/q2*+1;/p-2
• InChIKey: YRPPIMNBOSCROA-UHFFFAOYSA-L