CAS
68085-85-8 Purity
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68085-85-8 Purity
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Specification
The molecular formula is C20H42N2O5S.
The molecular weight is 422.6 g/mol.
The IUPAC name is 3-[3-(dodecanoylamino)propyl-dimethylazaniumyl]-2-hydroxypropane-1-sulfonate.
The InChI key is IXOCGRPBILEGOX-UHFFFAOYSA-N.
The canonical SMILES is CCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(CS(=O)(=O)[O-])O.
The CAS number is 19223-55-3.
The EC number is 242-893-1.
The UNII code is VPE363894V.
The topological polar surface area is 115 ?2.