Perhydro-1,5-oxazocine
TL;DR: Perhydro-1,5-oxazocine (CAS 107261-81-4) is a chemical compound with molecular formula C6H13NO and molecular weight 115.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-oxazocane
Also Known As: 1,5-oxazocane, Perhydro-1,5-oxazocine, 2H-1,5-Oxazocine,hexahydro-, 2-Propen-1-amine, N-(1-methylethyl)-3-phenyl-, (E)-, RefChem:171701
| Molecular Formula | C6H13NO |
|---|---|
| Molecular Weight | 115.10 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 115.09972 |
| Heavy Atoms | 8 |
| Complexity | 50.0 |
Chemical Identifiers
| CAS Number | 107261-81-4 |
|---|---|
| SMILES | C1CNCCCOC1 |
| InChIKey | BMTZFAWRALJMOS-UHFFFAOYSA-N |
Product Overview
Perhydro-1,5-oxazocine (CAS 107261-81-4), with molecular formula C6H13NO and molecular weight 115.10 g/mol. IUPAC: 1,5-oxazocane.
Chemical Property Profile of Perhydro-1,5-oxazocine
Property Insights of Perhydro-1,5-oxazocine
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Perhydro-1,5-oxazocine. With a topological polar surface area (TPSA) of 21.3 Ų, Perhydro-1,5-oxazocine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Perhydro-1,5-oxazocine has 1 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 Perhydro-1,5-oxazocine?
The CAS number of Perhydro-1,5-oxazocine is 107261-81-4.
What is the molecular formula of Perhydro-1,5-oxazocine?
The molecular formula of Perhydro-1,5-oxazocine is C6H13NO.
What is the molecular weight of Perhydro-1,5-oxazocine?
The molecular weight of Perhydro-1,5-oxazocine is 115.10 g/mol.
Where can I buy Perhydro-1,5-oxazocine?
You can request a quote for Perhydro-1,5-oxazocine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Perhydro-1,5-oxazocine?
Yes, KEHONG BIO provides custom synthesis services for Perhydro-1,5-oxazocine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.