3,6-Epoxytropane
TL;DR: 3,6-Epoxytropane (CAS 38225-15-9) is a chemical compound with molecular formula C8H13NO and molecular weight 139.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-2-oxa-6-azatricyclo[3.3.1.03,7]nonane
Also Known As: Deoxyoscine, Deoxyscopoline, 3,6-Epoxytropane, Hexahydro-4-methyl-2,5-methano-2H-furo[3,2-b]pyrrole, 2,5-Methano-2H-furo[3,2-b]pyrrole, hexahydro-4-methyl-
| Molecular Formula | C8H13NO |
|---|---|
| Molecular Weight | 139.10 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 139.09972 |
| Heavy Atoms | 10 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 38225-15-9 |
|---|---|
| SMILES | CN1C2CC3CC1C(C2)O3 |
| InChIKey | KJWBEHVDBCWHLY-UHFFFAOYSA-N |
Product Overview
3,6-Epoxytropane (CAS 38225-15-9), with molecular formula C8H13NO and molecular weight 139.10 g/mol. IUPAC: 6-methyl-2-oxa-6-azatricyclo[3.3.1.03,7]nonane.
Chemical Property Profile of 3,6-Epoxytropane
Property Insights of 3,6-Epoxytropane
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,6-Epoxytropane. With a topological polar surface area (TPSA) of 12.5 Ų, 3,6-Epoxytropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,6-Epoxytropane 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 3,6-Epoxytropane?
The CAS number of 3,6-Epoxytropane is 38225-15-9.
What is the molecular formula of 3,6-Epoxytropane?
The molecular formula of 3,6-Epoxytropane is C8H13NO.
What is the molecular weight of 3,6-Epoxytropane?
The molecular weight of 3,6-Epoxytropane is 139.10 g/mol.
Where can I buy 3,6-Epoxytropane?
You can request a quote for 3,6-Epoxytropane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Epoxytropane?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Epoxytropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.