(1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine
TL;DR: (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine (CAS 5176-08-9) is a chemical compound with molecular formula C10H18BrN and molecular weight 231.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine
Also Known As: TOS-BB-0897, J1.553.141J, (1R,9aR)-1-(bromomethyl)-octahydro-1H-quinolizine, (1R,9abeta)-1alpha-(Bromomethyl)octahydro-2H-quinolizine, (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine
| Molecular Formula | C10H18BrN |
|---|---|
| Molecular Weight | 231.06 g/mol |
| LogP | 2.6458 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 231.06226 |
| Heavy Atoms | 12 |
| Complexity | 140.01912 |
Chemical Identifiers
| CAS Number | 5176-08-9 |
|---|---|
| SMILES | C1CCN2CCC[C@H]([C@H]2C1)CBr |
Product Overview
(1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine (CAS 5176-08-9), with molecular formula C10H18BrN and molecular weight 231.06 g/mol. IUPAC: (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine.
Chemical Property Profile of (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine
Property Insights of (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine
The XLogP value of 2.6458 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine. With a topological polar surface area (TPSA) of 3.24 Ų, (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine has 0 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 (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine?
The CAS number of (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine is 5176-08-9.
What is the molecular formula of (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine?
The molecular formula of (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine is C10H18BrN.
What is the molecular weight of (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine?
The molecular weight of (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine is 231.06 g/mol.
Where can I buy (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine?
You can request a quote for (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine?
Yes, KEHONG BIO provides custom synthesis services for (1R,9aR)-1-(bromomethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.