(2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene
TL;DR: (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene (CAS 72323-36-5) is a chemical compound with molecular formula C12H22OS and molecular weight 214.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene
Also Known As: (E)-3,7-dimethyl-1-methylsulfanylmethoxy-octa-2,6-diene, (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene
| Molecular Formula | C12H22OS |
|---|---|
| Molecular Weight | 214.14 g/mol |
| LogP | 4.0162 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 214.13913 |
| Heavy Atoms | 14 |
| Complexity | 190.49841 |
Chemical Identifiers
| CAS Number | 72323-36-5 |
|---|---|
| SMILES | CC(=CCC/C(=C/COCSC)/C)C |
Product Overview
(2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene (CAS 72323-36-5), with molecular formula C12H22OS and molecular weight 214.14 g/mol. IUPAC: (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene.
Chemical Property Profile of (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene
Property Insights of (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene
The XLogP value of 4.0162 indicates that (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene?
The CAS number of (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene is 72323-36-5.
What is the molecular formula of (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene?
The molecular formula of (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene is C12H22OS.
What is the molecular weight of (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene?
The molecular weight of (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene is 214.14 g/mol.
Where can I buy (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene?
You can request a quote for (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3,7-dimethyl-1-(methylsulfanylmethoxy)octa-2,6-diene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.