6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl-
TL;DR: 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl- (CAS 137720-41-3) is a chemical compound with molecular formula C9H16O2 and molecular weight 156.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-5-methyl-6,8-dioxabicyclo[3.2.1]octane
Also Known As: 5-Ethyl-1-methyl-6,8-dioxabicyclo(3.2.1)octane, 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl-, 5-ethyl-1-methyl-7,8-dioxabicyclo[3.2.1]octane, 1-ethyl-5-methyl-6,8-dioxabicyclo[3.2.1]octane, RefChem:306362
| Molecular Formula | C9H16O2 |
|---|---|
| Molecular Weight | 156.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.11504 |
| Heavy Atoms | 11 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 137720-41-3 |
|---|---|
| SMILES | CCC12CCCC(O1)(OC2)C |
| InChIKey | QXEAOCBXEPPURY-UHFFFAOYSA-N |
Product Overview
6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl- (CAS 137720-41-3), with molecular formula C9H16O2 and molecular weight 156.12 g/mol. IUPAC: 1-ethyl-5-methyl-6,8-dioxabicyclo[3.2.1]octane.
Chemical Property Profile of 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl-
Property Insights of 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl-. With a topological polar surface area (TPSA) of 18.5 Ų, 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl- 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 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl-?
The CAS number of 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl- is 137720-41-3.
What is the molecular formula of 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl-?
The molecular formula of 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl- is C9H16O2.
What is the molecular weight of 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl-?
The molecular weight of 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl- is 156.12 g/mol.
Where can I buy 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl-?
You can request a quote for 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 6,8-Dioxabicyclo(3.2.1)octane, 1-ethyl-5-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.