8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate
TL;DR: 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate (CAS 76777-11-2) is a chemical compound with molecular formula C16H21NO5 and molecular weight 307.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-9-methyl-9-azatricyclo[6.4.1.02,7]trideca-2(7),3,5-triene;oxalic acid
Also Known As: 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate, 2'-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate, 1,6-Methano-2-benzazocine, 1,2,3,4,5,6-hexahydro-8-methoxy-2-methyl-, oxalate, Oxalic acid--8-methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine (1/1), RefChem:1093974
| Molecular Formula | C16H21NO5 |
|---|---|
| Molecular Weight | 307.14 g/mol |
| LogP | 2.1048 |
| Topological Polar Surface Area | 87.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 307.14197 |
| Heavy Atoms | 22 |
| Complexity | 559.65466 |
Chemical Identifiers
| CAS Number | 76777-11-2 |
|---|---|
| SMILES | CN1CCCC2CC1C3=C2C=C(C=C3)OC.C(=O)(C(=O)O)O |
Product Overview
8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate (CAS 76777-11-2), with molecular formula C16H21NO5 and molecular weight 307.14 g/mol. IUPAC: 4-methoxy-9-methyl-9-azatricyclo[6.4.1.02,7]trideca-2(7),3,5-triene;oxalic acid.
Chemical Property Profile of 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate
Property Insights of 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate
The XLogP value of 2.1048 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate. The TPSA of 87.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate. Following Lipinski's Rule of Five, 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate has 2 hydrogen bond donor(s) and 4 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 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate?
The CAS number of 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate is 76777-11-2.
What is the molecular formula of 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate?
The molecular formula of 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate is C16H21NO5.
What is the molecular weight of 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate?
The molecular weight of 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate is 307.14 g/mol.
Where can I buy 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate?
You can request a quote for 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate?
Yes, KEHONG BIO provides custom synthesis services for 8-Methoxy-2-methyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.