Hexadecyl methyl sulfide
TL;DR: Hexadecyl methyl sulfide (CAS 27563-68-4) is a chemical compound with molecular formula C17H36S and molecular weight 272.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylsulfanylhexadecane
Also Known As: Hexadecyl methyl sulfide, 1-methylsulfanylhexadecane, Sulfide, hexadecyl methyl, Methylhexadecyl sulfide, HEXADECYLMETHYLSULFIDE
| Molecular Formula | C17H36S |
|---|---|
| Molecular Weight | 272.25 g/mol |
| LogP | 6.8307 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 15 |
| Exact Mass | 272.25378 |
| Heavy Atoms | 18 |
| Complexity | 117.571785 |
Chemical Identifiers
| CAS Number | 27563-68-4 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCSC |
Product Overview
Hexadecyl methyl sulfide (CAS 27563-68-4), with molecular formula C17H36S and molecular weight 272.25 g/mol. IUPAC: 1-methylsulfanylhexadecane.
Chemical Property Profile of Hexadecyl methyl sulfide
Property Insights of Hexadecyl methyl sulfide
The XLogP value of 6.8307 indicates that Hexadecyl methyl sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Hexadecyl methyl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexadecyl methyl sulfide has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hexadecyl methyl sulfide?
The CAS number of Hexadecyl methyl sulfide is 27563-68-4.
What is the molecular formula of Hexadecyl methyl sulfide?
The molecular formula of Hexadecyl methyl sulfide is C17H36S.
What is the molecular weight of Hexadecyl methyl sulfide?
The molecular weight of Hexadecyl methyl sulfide is 272.25 g/mol.
Where can I buy Hexadecyl methyl sulfide?
You can request a quote for Hexadecyl methyl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexadecyl methyl sulfide?
Yes, KEHONG BIO provides custom synthesis services for Hexadecyl methyl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.