Arecoline Hydrobromide
TL;DR: Arecoline Hydrobromide (CAS 300-08-3) is a chemical compound with molecular formula C8H14BrNO2 and molecular weight 235.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-methyl-3,6-dihydro-2H-pyridine-5-carboxylate;hydrobromide
Also Known As: Arecoline hydrobromide, arecoline, Taeniolin, ARECOLINE HBr, Arecoline bromide
| Molecular Formula | C8H14BrNO2 |
|---|---|
| Molecular Weight | 235.02 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.02078 |
| Heavy Atoms | 12 |
| Complexity | 187.0 |
| Solubility | >35.4 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 300-08-3 |
|---|---|
| SMILES | CN1CCC=C(C1)C(=O)OC.Br |
| InChIKey | AXOJRQLKMVSHHZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Arecoline Hydrobromide (CAS 300-08-3), with molecular formula C8H14BrNO2 and molecular weight 235.02 g/mol. IUPAC: methyl 1-methyl-3,6-dihydro-2H-pyridine-5-carboxylate;hydrobromide.
Chemical Property Profile of Arecoline Hydrobromide
Property Insights of Arecoline Hydrobromide
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Arecoline Hydrobromide. With a topological polar surface area (TPSA) of 29.5 Ų, Arecoline Hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Arecoline Hydrobromide has 1 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 Arecoline Hydrobromide?
The CAS number of Arecoline Hydrobromide is 300-08-3.
What is the molecular formula of Arecoline Hydrobromide?
The molecular formula of Arecoline Hydrobromide is C8H14BrNO2.
What is the molecular weight of Arecoline Hydrobromide?
The molecular weight of Arecoline Hydrobromide is 235.02 g/mol.
Where can I buy Arecoline Hydrobromide?
You can request a quote for Arecoline Hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Arecoline Hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for Arecoline Hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.