1,3-Oxathiane, 2-ethyl-2,6-dimethyl-
TL;DR: 1,3-Oxathiane, 2-ethyl-2,6-dimethyl- (CAS 110271-13-1) is a chemical compound with molecular formula C8H16OS and molecular weight 160.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-2,6-dimethyl-1,3-oxathiane
Also Known As: 1,3-Oxathiane, 2-ethyl-2,6-dimethyl-, 2-Ethyl-2,6-dimethyl-1,3-oxathiane, 1,3-Oxathiane,2-ethyl-2,6-dimethyl-,trans, 1,3-Oxathiane, 2-ethyl-2,6-dimethyl-, cis-, RefChem:219358
| Molecular Formula | C8H16OS |
|---|---|
| Molecular Weight | 160.09 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.0922 |
| Heavy Atoms | 10 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 110271-13-1 |
|---|---|
| SMILES | CCC1(OC(CCS1)C)C |
| InChIKey | YVLBDUNYLRKAHD-UHFFFAOYSA-N |
Product Overview
1,3-Oxathiane, 2-ethyl-2,6-dimethyl- (CAS 110271-13-1), with molecular formula C8H16OS and molecular weight 160.09 g/mol. IUPAC: 2-ethyl-2,6-dimethyl-1,3-oxathiane.
Chemical Property Profile of 1,3-Oxathiane, 2-ethyl-2,6-dimethyl-
Property Insights of 1,3-Oxathiane, 2-ethyl-2,6-dimethyl-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Oxathiane, 2-ethyl-2,6-dimethyl-. With a topological polar surface area (TPSA) of 34.5 Ų, 1,3-Oxathiane, 2-ethyl-2,6-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Oxathiane, 2-ethyl-2,6-dimethyl- 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 1,3-Oxathiane, 2-ethyl-2,6-dimethyl-?
The CAS number of 1,3-Oxathiane, 2-ethyl-2,6-dimethyl- is 110271-13-1.
What is the molecular formula of 1,3-Oxathiane, 2-ethyl-2,6-dimethyl-?
The molecular formula of 1,3-Oxathiane, 2-ethyl-2,6-dimethyl- is C8H16OS.
What is the molecular weight of 1,3-Oxathiane, 2-ethyl-2,6-dimethyl-?
The molecular weight of 1,3-Oxathiane, 2-ethyl-2,6-dimethyl- is 160.09 g/mol.
Where can I buy 1,3-Oxathiane, 2-ethyl-2,6-dimethyl-?
You can request a quote for 1,3-Oxathiane, 2-ethyl-2,6-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Oxathiane, 2-ethyl-2,6-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Oxathiane, 2-ethyl-2,6-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.