1-Propanaminium, N-[2-[bis(2-hydroxypropyl)amino]ethyl]-2-hydroxy-N-(2-hydroxypropyl)-N-methyl-, di-(9Z)-9-octadecenoate (ester), methyl sulfate (1:1)
CAS Registry Number®
65059-61-2
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CAS Name
1-Propanaminium, N-[2-[bis(2-hydroxypropyl)amino]ethyl]-2-hydroxy-N-(2-hydroxypropyl)-N-methyl-, di-(9Z)-9-octadecenoate (ester), methyl sulfate (1:1)Molecular Formula
C51H99N2O6.CH3O4SCite this Page
1-Propanaminium, N-[2-[bis(2-hydroxypropyl)amino]ethyl]-2-hydroxy-N-(2-hydroxypropyl)-N-methyl-, di-(9Z)-9-octadecenoate (ester), methyl sulfate (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=65059-61-2 (retrieved ) (CAS RN: 65059-61-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C18H34O2.C15H35N2O4.CH4O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-12(18)8-16(9-13(2)19)6-7-17(5,10-14(3)20)11-15(4)21;1-5-6(2,3)4/h9-10H,2-8,11-17H2,1H3,(H,19,20);12-15,18-21H,6-11H2,1-5H3;1H3,(H,2,3,4)/q;+1;/p-1/b10-9-;;
InChIKey
InChIKey=IPRWBBIGUSNDST-XXAVUKJNSA-M
SMILES
S(OC)(=O)(=O)[O-].[N+](CCN(CC(C)O)CC(C)O)(CC(C)O)(CC(C)O)C.C(C/C=C\CCCCCCCC)CCCCCC(O)=O
Canonical SMILES
O=C(O)CCCCCCCC=CCCCCCCCC.O=S(=O)([O-])OC.OC(C)CN(CC[N+](C)(CC(O)C)CC(O)C)CC(O)C
Other Names for this Substance
- 1-Propanaminium, N-[2-[bis(2-hydroxypropyl)amino]ethyl]-2-hydroxy-N-(2-hydroxypropyl)-N-methyl-, di-(9Z)-9-octadecenoate (ester), methyl sulfate (1:1)
- 1-Propanaminium, N-[2-[bis(2-hydroxypropyl)amino]ethyl]-2-hydroxy-N-(2-hydroxypropyl)-N-methyl-, bis[(Z)-9-octadecenoate] (ester), methyl sulfate (salt)
- 1-Propanaminium, N-[2-[bis(2-hydroxypropyl)amino]ethyl]-2-hydroxy-N-(2-hydroxypropyl)-N-methyl-, di-(9Z)-9-octadecenoate (ester), methyl sulfate (salt)
