1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1)
TL;DR: 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1) (CAS 76777-25-8) is a chemical compound with molecular formula C12H16ClN and molecular weight 209.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-azatricyclo[6.4.1.02,7]trideca-2,4,6-triene;hydrochloride
Also Known As: 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine hydrochloride, 1,6-Methano-2-benzazocine, 1,2,3,4,5,6-hexahydro-, hydrochloride, 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1), RefChem:1051901
| Molecular Formula | C12H16ClN |
|---|---|
| Molecular Weight | 209.10 g/mol |
| LogP | 3.0202 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 209.09712 |
| Heavy Atoms | 14 |
| Complexity | 292.8527 |
Chemical Identifiers
| CAS Number | 76777-25-8 |
|---|---|
| SMILES | C1CC2CC(C3=CC=CC=C23)NC1.Cl |
Product Overview
1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1) (CAS 76777-25-8), with molecular formula C12H16ClN and molecular weight 209.10 g/mol. IUPAC: 9-azatricyclo[6.4.1.02,7]trideca-2,4,6-triene;hydrochloride.
Chemical Property Profile of 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1)
Property Insights of 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1)
The XLogP value of 3.0202 indicates that 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1) has 1 hydrogen bond donor(s) and 1 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 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1)?
The CAS number of 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1) is 76777-25-8.
What is the molecular formula of 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1)?
The molecular formula of 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1) is C12H16ClN.
What is the molecular weight of 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1)?
The molecular weight of 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1) is 209.10 g/mol.
Where can I buy 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1)?
You can request a quote for 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4,5,6-Hexahydro-1,6-methano-2-benzazocine--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.