99155-80-3 Purity
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Specification
The molecular formula of Octadecyl sulfoxide is C36H74OS.
The molecular weight of Octadecyl sulfoxide is 555.0 g/mol.
The IUPAC name of Octadecyl sulfoxide is 1-octadecylsulfinyloctadecane.
The InChI of Octadecyl sulfoxide is InChI=1S/C36H74OS/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-38(37)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-36H2,1-2H3.
The InChIKey of Octadecyl sulfoxide is MBNAHLVKLCADIR-UHFFFAOYSA-N.
The canonical SMILES of Octadecyl sulfoxide is CCCCCCCCCCCCCCCCCCS(=O)CCCCCCCCCCCCCCCCCC.
The XLogP3-AA value of Octadecyl sulfoxide is 16.9.
There are 0 hydrogen bond donor counts in Octadecyl sulfoxide.
There are 34 rotatable bond counts in Octadecyl sulfoxide.
Yes, the compound is canonicalized for Octadecyl sulfoxide.