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Reference substances

Reference substances

Currently viewing:
IUPAC name:
magnesium bis(dodecyl sulfate)

Inventory

EC number:
221-450-6
EC name:
Magnesium dodecylsulfate
CAS number:
3097-08-3
CAS number:
3097-08-3
Synonyms
Names:
1-Dodecanol,hydrogensulfate, magnesium salt
1-Dodecanol1,-(hydrogen sulfate), magnesium salt (2:1)
Magnesium lauryl sulfate
Sulfuric acid, monododecyl ester, magnesium salt (2:1)
Identifier:
IUPAC name
Magnesium dodecyl Sulfate
Identifier:
other: Molecular formula
C12H26O4S.1/2Mg or C24H50O8S2.Mg
Identifier:
other: InChl
InChI=1S/2C12H26O4S.Mg/c2*1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15;/h2*2-12H2,1H3,(H,13,14,15);/q;;+2/p-2
Identifier:
other: SMILES notation
O=S(OCCOCCCCCCCCCCCC)([O-])=O.O=S(OCCOCCCCCCCCCCCC)([O-])=O.[Mg+2]

Molecular and structural information

Molecular formula:
C12H26O4S.1/2Mg
Molecular weight:
555.084
SMILES notation:
CCCCCCCCCCCCOS(=O)(=O)O[Mg]OS(=O)(=O)OCCCCCCCCCCCC
InChl:
InChI=1/2C12H26O4S.Mg/c2*1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15;/h2*2-12H2,1H3,(H,13,14,15);/q;;+2/p-2/rC24H50MgO8S2/c1-3-5-7-9-11-13-15-17-19-21-23-30-34(26,27)32-25-33-35(28,29)31-24-22-20-18-16-14-12-10-8-6-4-2/h3-24H2,1-2H3
Structural formula:
Chemical structure

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