3-Quinolin-3-ylprop-2-yn-1-ol
TL;DR: 3-Quinolin-3-ylprop-2-yn-1-ol (CAS 70437-05-7) is a chemical compound with molecular formula C12H9NO and molecular weight 183.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-quinolin-3-ylprop-2-yn-1-ol
Also Known As: 3-(Quinolin-3-yl)prop-2-yn-1-ol, 3-quinolin-3-ylprop-2-yn-1-ol, 3-(3-quinolyl)prop-2-yn-1-ol, 3-(3-quinolinyl)-2-propyn-1-ol, 3-Quinolin-3-yl-prop-2-yn-1-ol
| Molecular Formula | C12H9NO |
|---|---|
| Molecular Weight | 183.07 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 33.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 183.06842 |
| Heavy Atoms | 14 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 70437-05-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C=N2)C#CCO |
| InChIKey | BATAIOGYFWEXQV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Quinolin-3-ylprop-2-yn-1-ol (CAS 70437-05-7), with molecular formula C12H9NO and molecular weight 183.07 g/mol. IUPAC: 3-quinolin-3-ylprop-2-yn-1-ol.
Chemical Property Profile of 3-Quinolin-3-ylprop-2-yn-1-ol
Property Insights of 3-Quinolin-3-ylprop-2-yn-1-ol
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Quinolin-3-ylprop-2-yn-1-ol. With a topological polar surface area (TPSA) of 33.1 Ų, 3-Quinolin-3-ylprop-2-yn-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Quinolin-3-ylprop-2-yn-1-ol 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 3-Quinolin-3-ylprop-2-yn-1-ol?
The CAS number of 3-Quinolin-3-ylprop-2-yn-1-ol is 70437-05-7.
What is the molecular formula of 3-Quinolin-3-ylprop-2-yn-1-ol?
The molecular formula of 3-Quinolin-3-ylprop-2-yn-1-ol is C12H9NO.
What is the molecular weight of 3-Quinolin-3-ylprop-2-yn-1-ol?
The molecular weight of 3-Quinolin-3-ylprop-2-yn-1-ol is 183.07 g/mol.
Where can I buy 3-Quinolin-3-ylprop-2-yn-1-ol?
You can request a quote for 3-Quinolin-3-ylprop-2-yn-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Quinolin-3-ylprop-2-yn-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-Quinolin-3-ylprop-2-yn-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.