55184-72-0
SODIUM 1,4-BIS[(11-METHYLDODECYL)OXY]-1,4-DIOXO-2-BUTANESULFONATE
Name
SODIUM 1,4-BIS[(11-METHYLDODECYL)OXY]-1,4-DIOXO-2-BUTANESULFONATE
Formula
C30 H57 O7 S . Na
MolWeight
584.829
1Identification
【Name】
SODIUM 1,4-BIS[(11-METHYLDODECYL)OXY]-1,4-DIOXO-2-BUTANESULFONATE
【CAS】
【MDL】
MFCD23160513
【English Synonyms】
【Formula】
C30 H57 O7 S . Na
【MolWeight】
584.829
【Inchi】
InChI=1S/C30H58O7S.Na/c1-26(2)21-17-13-9-5-7-11-15-19-23-36-29(31)25-28(38(33,34)35)30(32)37-24-20-16-12-8-6-10-14-18-22-27(3)4;/h26-28H,5-25H2,1-4H3,(H,33,34,35);/q;+1/p-1
【InChIKey】
InChIKey=QJLUBHNDVAQAPK-UHFFFAOYSA-M
【SMILES】
CC(C)CCCCCCCCCCOC(=O)CC(C(=O)OCCCCCCCCCCC(C)C)S(=O)(=O)[O-].[Na+]
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:7
XLogP3:11.0
Bulk/Fine:F