C51H99N2O6.CH3O4S

2-hydroxypropyl-[2-[2-hydroxypropyl(2-octadec-9-enoyloxypropyl)amino]ethyl]-methyl-(2-octadec-10-enoyloxypropyl)azanium;methyl sulfate

Also Known As: QUATERNIUM-82|EINECS 265-339-0|1-Propanaminium, N-[2-[bis(2-hydroxypropyl)amino]ethyl]-2-hydroxy-N-(2-hydroxypropyl)-N-methyl-, di-(9Z)-9-octadecenoate (ester), methyl sulfate (salt)|[2- [bis(2- hydroxypropyl)amino]ethyl]bis(2- hydroxypropyl)(methyl)ammonium methyl sulphate, dioleate (ester)|[2-[bis-(2-Hydroxypropyl)amino]ethyl]bis(2-hydroxypropyl)(methyl)ammonium methyl sulfate, dioleate (ester)|[2-[Bis-(2-hydroxypropyl)amino]ethyl]bis(2-hydroxypropyl)(methyl)ammonium methyl sulfate,dioleate(ester)|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-, di-(9Z)-9-octadecenoate (ester), methyl sulfate (salt)|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-, bis[(Z)-9-octadecenoate] (ester), methyl sulfate (salt)

Molecular Formula	C52H102N2O10S
Molecular Weight	946.7255 g/mol
LogP	11.53
Topological Polar Surface Area	162.73 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	11
Rotatable Bonds	44
Exact Mass	946.7255
Heavy Atoms	65
Complexity	1262.1

Chemical Identifiers

CAS Number	65059-61-2
SMILES	CCCCCCCCC=CCCCCCCCC(=O)OC(C)CN(CC[N+](C)(CC(C)O)CC(C)OC(=O)CCCCCCCCC=CCCCCCCC)CC(C)O.COS(=O)(=O)[O-]