槟榔碱
TL;DR: 槟榔碱 (CAS 63-75-2) is a chemical compound with molecular formula C8H13NO2 and molecular weight 155.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
槟榔碱
methyl 1-methyl-3,6-dihydro-2H-pyridine-5-carboxylate
Also Known As: arecoline, Arecolin, Arecholine, Arecaline, Methylarecaiden
| Molecular Formula | C8H13NO2 |
|---|---|
| Molecular Weight | 155.09 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 155.09464 |
| Heavy Atoms | 11 |
| Complexity | 187.0 |
| Melting Point | < 25 °C |
| Boiling Point | 209 |
| Solubility | 1000000 |
Chemical Identifiers
| CAS Number | 63-75-2 |
|---|---|
| SMILES | CN1CCC=C(C1)C(=O)OC |
| InChIKey | HJJPJSXJAXAIPN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
槟榔碱 (CAS 63-75-2), with molecular formula C8H13NO2 and molecular weight 155.09 g/mol. IUPAC: methyl 1-methyl-3,6-dihydro-2H-pyridine-5-carboxylate.
Chemical Property Profile of 槟榔碱
Property Insights of 槟榔碱
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 槟榔碱. With a topological polar surface area (TPSA) of 29.5 Ų, 槟榔碱 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 槟榔碱 has 0 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 槟榔碱?
The CAS number of 槟榔碱 is 63-75-2.
What is the molecular formula of 槟榔碱?
The molecular formula of 槟榔碱 is C8H13NO2.
What is the molecular weight of 槟榔碱?
The molecular weight of 槟榔碱 is 155.09 g/mol.
Where can I buy 槟榔碱?
You can request a quote for 槟榔碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 槟榔碱?
Yes, KEHONG BIO provides custom synthesis services for 槟榔碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.