1-(chloromethyl)octahydro-2H-quinolizine
TL;DR: 1-(chloromethyl)octahydro-2H-quinolizine (CAS 91049-90-0) is a chemical compound with molecular formula C10H18ClN and molecular weight 187.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(chloromethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine
Also Known As: Chlorolupinine, 1-(chloromethyl)octahydro-2H-quinolizine, chlorolupinin, 1-(chloromethyl)-octahydro-1H-quinolizine, 1-(Chloromethyl)octahydro-1H-quinolizine
| Molecular Formula | C10H18ClN |
|---|---|
| Molecular Weight | 187.11 g/mol |
| LogP | 2.4897 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 187.11278 |
| Heavy Atoms | 12 |
| Complexity | 140.01912 |
Chemical Identifiers
| CAS Number | 91049-90-0 |
|---|---|
| SMILES | C1CCN2CCCC(C2C1)CCl |
Product Overview
1-(chloromethyl)octahydro-2H-quinolizine (CAS 91049-90-0), with molecular formula C10H18ClN and molecular weight 187.11 g/mol. IUPAC: 1-(chloromethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine.
Chemical Property Profile of 1-(chloromethyl)octahydro-2H-quinolizine
Property Insights of 1-(chloromethyl)octahydro-2H-quinolizine
The XLogP value of 2.4897 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(chloromethyl)octahydro-2H-quinolizine. With a topological polar surface area (TPSA) of 3.24 Ų, 1-(chloromethyl)octahydro-2H-quinolizine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(chloromethyl)octahydro-2H-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 1-(chloromethyl)octahydro-2H-quinolizine?
The CAS number of 1-(chloromethyl)octahydro-2H-quinolizine is 91049-90-0.
What is the molecular formula of 1-(chloromethyl)octahydro-2H-quinolizine?
The molecular formula of 1-(chloromethyl)octahydro-2H-quinolizine is C10H18ClN.
What is the molecular weight of 1-(chloromethyl)octahydro-2H-quinolizine?
The molecular weight of 1-(chloromethyl)octahydro-2H-quinolizine is 187.11 g/mol.
Where can I buy 1-(chloromethyl)octahydro-2H-quinolizine?
You can request a quote for 1-(chloromethyl)octahydro-2H-quinolizine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(chloromethyl)octahydro-2H-quinolizine?
Yes, KEHONG BIO provides custom synthesis services for 1-(chloromethyl)octahydro-2H-quinolizine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.