4-Ethynyl-1-methyldecahydro-4-quinolinol
TL;DR: 4-Ethynyl-1-methyldecahydro-4-quinolinol (CAS 54924-02-6) is a chemical compound with molecular formula C12H19NO and molecular weight 193.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethynyl-1-methyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol
Also Known As: 4-Ethynyl-1-methyldecahydro-4-quinolinol, 4-Ethynyl-1-methyldecahydroquinolin-4-ol, methyl-4-ethynyldecahydro-4-quinolol, 4-ethynyl-1-methyl-decahydro-quinolin-4-ol, 4-Ethynyl-1-methyldecahydro-4-quinolinol #
| Molecular Formula | C12H19NO |
|---|---|
| Molecular Weight | 193.15 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.14667 |
| Heavy Atoms | 14 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 54924-02-6 |
|---|---|
| SMILES | CN1CCC(C2C1CCCC2)(C#C)O |
| InChIKey | DPXYTZVIPKWTFT-UHFFFAOYSA-N |
Product Overview
4-Ethynyl-1-methyldecahydro-4-quinolinol (CAS 54924-02-6), with molecular formula C12H19NO and molecular weight 193.15 g/mol. IUPAC: 4-ethynyl-1-methyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol.
Chemical Property Profile of 4-Ethynyl-1-methyldecahydro-4-quinolinol
Property Insights of 4-Ethynyl-1-methyldecahydro-4-quinolinol
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Ethynyl-1-methyldecahydro-4-quinolinol. With a topological polar surface area (TPSA) of 23.5 Ų, 4-Ethynyl-1-methyldecahydro-4-quinolinol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Ethynyl-1-methyldecahydro-4-quinolinol has 1 hydrogen bond donor(s) and 2 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 4-Ethynyl-1-methyldecahydro-4-quinolinol?
The CAS number of 4-Ethynyl-1-methyldecahydro-4-quinolinol is 54924-02-6.
What is the molecular formula of 4-Ethynyl-1-methyldecahydro-4-quinolinol?
The molecular formula of 4-Ethynyl-1-methyldecahydro-4-quinolinol is C12H19NO.
What is the molecular weight of 4-Ethynyl-1-methyldecahydro-4-quinolinol?
The molecular weight of 4-Ethynyl-1-methyldecahydro-4-quinolinol is 193.15 g/mol.
Where can I buy 4-Ethynyl-1-methyldecahydro-4-quinolinol?
You can request a quote for 4-Ethynyl-1-methyldecahydro-4-quinolinol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Ethynyl-1-methyldecahydro-4-quinolinol?
Yes, KEHONG BIO provides custom synthesis services for 4-Ethynyl-1-methyldecahydro-4-quinolinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.