alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride
TL;DR: alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride (CAS 2651-73-2) is a chemical compound with molecular formula C15H21ClFN and molecular weight 269.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,9S)-4-fluoro-1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-triene;hydrochloride
Also Known As: alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride, 8-Fluoro-1,2,3,4,5,6-hexahydro-3,6,11-trimethyl-2,6-methano-3-benzazocine hydrochloride, (2S,6R)-8-Fluoro-3,6,11-trimethyl-1,2,3,4,5,6-hexahydro-2,6-methano-3-benzazocine--hydrogen chloride (1/1), 2,6-Methano-3-benzazocine, 1,2,3,4,5,6-hexahydro-8-fluoro-3,6,11-trimethyl-, hydrochloride, 8-Fluoro-3,6,11-trimethyl-1,2,3,4,5,6-hexahydro-2,6-methano-3-benzazocine--hydrogen chloride (1/1)
| Molecular Formula | C15H21ClFN |
|---|---|
| Molecular Weight | 269.13 g/mol |
| LogP | 3.4015 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 269.13464 |
| Heavy Atoms | 18 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 2651-73-2 |
|---|---|
| SMILES | CC1[C@@H]2CC3=C([C@@]1(CCN2C)C)C=C(C=C3)F.Cl |
| InChIKey | DWOWBWJDACHGBX-GBLULCQRSA-N |
Product Overview
alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride (CAS 2651-73-2), with molecular formula C15H21ClFN and molecular weight 269.13 g/mol. IUPAC: (1R,9S)-4-fluoro-1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-triene;hydrochloride.
Chemical Property Profile of alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride
Property Insights of alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride
The XLogP value of 3.4015 indicates that alpha-2'-Fluoro-2,5,9-trimethyl-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 3.2 Ų, alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride 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 alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride?
The CAS number of alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride is 2651-73-2.
What is the molecular formula of alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride?
The molecular formula of alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride is C15H21ClFN.
What is the molecular weight of alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride?
The molecular weight of alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride is 269.13 g/mol.
Where can I buy alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride?
You can request a quote for alpha-2'-Fluoro-2,5,9-trimethyl-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 alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for alpha-2'-Fluoro-2,5,9-trimethyl-6,7-benzomorphan hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.