3-Pyridinemethanol, alpha-ethynyl-alpha-methyl-
TL;DR: 3-Pyridinemethanol, alpha-ethynyl-alpha-methyl- (CAS 99357-64-9) is a chemical compound with molecular formula C9H9NO and molecular weight 147.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyridin-3-ylbut-3-yn-2-ol
Also Known As: 2-(pyridin-3-yl)but-3-yn-2-ol, 2-pyridin-3-ylbut-3-yn-2-ol, 2-(3-pyridyl)but-3-yn-2-ol, ZERO/005340, 3-Pyridinemethanol, alpha-ethynyl-alpha-methyl-
| Molecular Formula | C9H9NO |
|---|---|
| Molecular Weight | 147.07 g/mol |
| LogP | 0.9223 |
| Topological Polar Surface Area | 33.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 147.06842 |
| Heavy Atoms | 11 |
| Complexity | 271.36426 |
Chemical Identifiers
| CAS Number | 99357-64-9 |
|---|---|
| SMILES | CC(C#C)(C1=CN=CC=C1)O |
Product Overview
3-Pyridinemethanol, alpha-ethynyl-alpha-methyl- (CAS 99357-64-9), with molecular formula C9H9NO and molecular weight 147.07 g/mol. IUPAC: 2-pyridin-3-ylbut-3-yn-2-ol.
Chemical Property Profile of 3-Pyridinemethanol, alpha-ethynyl-alpha-methyl-
Property Insights of 3-Pyridinemethanol, alpha-ethynyl-alpha-methyl-
The XLogP value of 0.9223 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Pyridinemethanol, alpha-ethynyl-alpha-methyl-. With a topological polar surface area (TPSA) of 33.12 Ų, 3-Pyridinemethanol, alpha-ethynyl-alpha-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Pyridinemethanol, alpha-ethynyl-alpha-methyl- 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-Pyridinemethanol, alpha-ethynyl-alpha-methyl-?
The CAS number of 3-Pyridinemethanol, alpha-ethynyl-alpha-methyl- is 99357-64-9.
What is the molecular formula of 3-Pyridinemethanol, alpha-ethynyl-alpha-methyl-?
The molecular formula of 3-Pyridinemethanol, alpha-ethynyl-alpha-methyl- is C9H9NO.
What is the molecular weight of 3-Pyridinemethanol, alpha-ethynyl-alpha-methyl-?
The molecular weight of 3-Pyridinemethanol, alpha-ethynyl-alpha-methyl- is 147.07 g/mol.
Where can I buy 3-Pyridinemethanol, alpha-ethynyl-alpha-methyl-?
You can request a quote for 3-Pyridinemethanol, alpha-ethynyl-alpha-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyridinemethanol, alpha-ethynyl-alpha-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyridinemethanol, alpha-ethynyl-alpha-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.