alpha-Ethynyl-4-methoxybenzenemethanol
TL;DR: alpha-Ethynyl-4-methoxybenzenemethanol (CAS 19115-30-1) is a chemical compound with molecular formula C10H10O2 and molecular weight 162.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxyphenyl)prop-2-yn-1-ol
Also Known As: 1-(4-methoxyphenyl)prop-2-yn-1-ol, OHDHE, 1-(4-methoxyphenyl)-2-propyn-1-ol, 1'-Hydroxy-2',3'-dehydroestragole, alpha-Ethynyl-p-methoxybenzyl alcohol
| Molecular Formula | C10H10O2 |
|---|---|
| Molecular Weight | 162.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 162.06808 |
| Heavy Atoms | 12 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 19115-30-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(C#C)O |
| InChIKey | NJWJWMOLQUOFJR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
alpha-Ethynyl-4-methoxybenzenemethanol (CAS 19115-30-1), with molecular formula C10H10O2 and molecular weight 162.07 g/mol. IUPAC: 1-(4-methoxyphenyl)prop-2-yn-1-ol.
Chemical Property Profile of alpha-Ethynyl-4-methoxybenzenemethanol
Property Insights of alpha-Ethynyl-4-methoxybenzenemethanol
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-Ethynyl-4-methoxybenzenemethanol. With a topological polar surface area (TPSA) of 29.5 Ų, alpha-Ethynyl-4-methoxybenzenemethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Ethynyl-4-methoxybenzenemethanol 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 alpha-Ethynyl-4-methoxybenzenemethanol?
The CAS number of alpha-Ethynyl-4-methoxybenzenemethanol is 19115-30-1.
What is the molecular formula of alpha-Ethynyl-4-methoxybenzenemethanol?
The molecular formula of alpha-Ethynyl-4-methoxybenzenemethanol is C10H10O2.
What is the molecular weight of alpha-Ethynyl-4-methoxybenzenemethanol?
The molecular weight of alpha-Ethynyl-4-methoxybenzenemethanol is 162.07 g/mol.
Where can I buy alpha-Ethynyl-4-methoxybenzenemethanol?
You can request a quote for alpha-Ethynyl-4-methoxybenzenemethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Ethynyl-4-methoxybenzenemethanol?
Yes, KEHONG BIO provides custom synthesis services for alpha-Ethynyl-4-methoxybenzenemethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.