2-Ethylhexyl sulfide
TL;DR: 2-Ethylhexyl sulfide (CAS 1674-29-9) is a chemical compound with molecular formula C16H34S and molecular weight 258.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-ethylhexylsulfanylmethyl)heptane
Also Known As: 2-Ethylhexyl Sulfide, Sulfide, bis(2-ethylhexyl), bis(2-ethylhexyl) sulfide, di(2 ethylhexyl)thio, bis(2-ethylhexyl)sulfane
| Molecular Formula | C16H34S |
|---|---|
| Molecular Weight | 258.24 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 12 |
| Exact Mass | 258.23813 |
| Heavy Atoms | 17 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 1674-29-9 |
|---|---|
| SMILES | CCCCC(CC)CSCC(CC)CCCC |
| InChIKey | UGASTCGQAJBUOO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Ethylhexyl sulfide (CAS 1674-29-9), with molecular formula C16H34S and molecular weight 258.24 g/mol. IUPAC: 3-(2-ethylhexylsulfanylmethyl)heptane.
Chemical Property Profile of 2-Ethylhexyl sulfide
Property Insights of 2-Ethylhexyl sulfide
The XLogP value of 7.1 indicates that 2-Ethylhexyl sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, 2-Ethylhexyl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethylhexyl 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 2-Ethylhexyl sulfide?
The CAS number of 2-Ethylhexyl sulfide is 1674-29-9.
What is the molecular formula of 2-Ethylhexyl sulfide?
The molecular formula of 2-Ethylhexyl sulfide is C16H34S.
What is the molecular weight of 2-Ethylhexyl sulfide?
The molecular weight of 2-Ethylhexyl sulfide is 258.24 g/mol.
Where can I buy 2-Ethylhexyl sulfide?
You can request a quote for 2-Ethylhexyl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethylhexyl sulfide?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethylhexyl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.