94236-90-5 Purity
96%
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Specification
The molecular formula of Diammonium 1-icosyl 2-sulfonatosuccinate is C24H52N2O7S.
The molecular weight of Diammonium 1-icosyl 2-sulfonatosuccinate is 512.7 g/mol.
The IUPAC name of Diammonium 1-icosyl 2-sulfonatosuccinate is diazanium;4-icosoxy-4-oxo-3-sulfonatobutanoate.
The InChI of Diammonium 1-icosyl 2-sulfonatosuccinate is InChI=1S/C24H46O7S.2H3N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-31-24(27)22(21-23(25)26)32(28,29)30;;/h22H,2-21H2,1H3,(H,25,26)(H,28,29,30);2*1H3.
The InChIKey of Diammonium 1-icosyl 2-sulfonatosuccinate is HCSHBWZSWCNZSL-UHFFFAOYSA-N.
There are 2 hydrogen bond donor counts in Diammonium 1-icosyl 2-sulfonatosuccinate.
There are 7 hydrogen bond acceptor counts in Diammonium 1-icosyl 2-sulfonatosuccinate.
The exact mass of Diammonium 1-icosyl 2-sulfonatosuccinate is 512.34952318 g/mol.
There are 22 rotatable bond counts in Diammonium 1-icosyl 2-sulfonatosuccinate.
Yes, Diammonium 1-icosyl 2-sulfonatosuccinate is a canonicalized compound.