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Structure

Octadecyl sulfoxide

CAS
99159-40-7
Catalog Number
ACM99159407
Category
Other Products
Molecular Weight
555.04
Molecular Formula
C36H74OS

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Specification

Synonyms
OCTADECYL SULFOXIDE
What is the molecular formula of Octadecyl sulfoxide?

The molecular formula of Octadecyl sulfoxide is C36H74OS.

What is the molecular weight of Octadecyl sulfoxide?

The molecular weight of Octadecyl sulfoxide is 555.0 g/mol.

What is the IUPAC name of Octadecyl sulfoxide?

The IUPAC name of Octadecyl sulfoxide is 1-octadecylsulfinyloctadecane.

What is the InChI of Octadecyl sulfoxide?

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.

What is the InChIKey of Octadecyl sulfoxide?

The InChIKey of Octadecyl sulfoxide is MBNAHLVKLCADIR-UHFFFAOYSA-N.

What is the canonical SMILES of Octadecyl sulfoxide?

The canonical SMILES of Octadecyl sulfoxide is CCCCCCCCCCCCCCCCCCS(=O)CCCCCCCCCCCCCCCCCC.

What is the XLogP3-AA value of Octadecyl sulfoxide?

The XLogP3-AA value of Octadecyl sulfoxide is 16.9.

How many hydrogen bond donor counts are there in Octadecyl sulfoxide?

There are 0 hydrogen bond donor counts in Octadecyl sulfoxide.

How many rotatable bond counts are there in Octadecyl sulfoxide?

There are 34 rotatable bond counts in Octadecyl sulfoxide.

Is the compound canonicalized for Octadecyl sulfoxide?

Yes, the compound is canonicalized for Octadecyl sulfoxide.

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