8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride
TL;DR: 8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride (CAS 63869-54-5) is a chemical compound with molecular formula C16H22ClNO2 and molecular weight 295.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,10-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-trien-8-yl) acetate;hydrochloride
Also Known As: 8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride, Acetic acid, 1,2,3,4,5,6-hexahydro-3,6-dimethyl-2,6-methano-3-benzazocin-1-yl ester, HCl, 2,6-Methano-3-benzazocin-1-ol, 1,2,3,4,5,6-hexahydro-3,6-dimethyl-, acetate(ester), hydrochloride, 3,6-Dimethyl-1,2,3,4,5,6-hexahydro-2,6-methano-3-benzazocin-1-yl acetate--hydrogen chloride (1/1), 2,6-Methano-3-benzazocin-1-ol, 1,2,3,4,5,6-hexahydro-3,6-dimethyl-, acetate (ester), hydrochloride
| Molecular Formula | C16H22ClNO2 |
|---|---|
| Molecular Weight | 295.13 g/mol |
| LogP | 3.0781 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 295.1339 |
| Heavy Atoms | 20 |
| Complexity | 518.95325 |
Chemical Identifiers
| CAS Number | 63869-54-5 |
|---|---|
| SMILES | CC(=O)OC1C2CC(CCN2C)(C3=CC=CC=C13)C.Cl |
Product Overview
8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride (CAS 63869-54-5), with molecular formula C16H22ClNO2 and molecular weight 295.13 g/mol. IUPAC: (1,10-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-trien-8-yl) acetate;hydrochloride.
Chemical Property Profile of 8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride
Property Insights of 8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride
The XLogP value of 3.0781 indicates that 8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride has 0 hydrogen bond donor(s) and 3 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-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride?
The CAS number of 8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride is 63869-54-5.
What is the molecular formula of 8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride?
The molecular formula of 8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride is C16H22ClNO2.
What is the molecular weight of 8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride?
The molecular weight of 8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride is 295.13 g/mol.
Where can I buy 8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride?
You can request a quote for 8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 8-Acetoxy-2,5-dimethyl-6,7-benzomorphan hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.