4-(4-Methoxyphenyl)but-3-yn-1-ol
TL;DR: 4-(4-Methoxyphenyl)but-3-yn-1-ol (CAS 52999-15-2) is a chemical compound with molecular formula C11H12O2 and molecular weight 176.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methoxyphenyl)but-3-yn-1-ol
Also Known As: 4-(4-methoxyphenyl)but-3-yn-1-ol, 4-(4-methoxyphenyl)-3-butyn-1-ol, 4-(4'-methoxy)phenyl-3-butyn-1-ol, 4-(4-Methoxyphenyl)-3-butyne-1-ol, 4-(4-methoxyphenyl)-but-3-yn-1-ol
| Molecular Formula | C11H12O2 |
|---|---|
| Molecular Weight | 176.08 g/mol |
| LogP | 1.4291 |
| Topological Polar Surface Area | 29.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.08372 |
| Heavy Atoms | 13 |
| Complexity | 303.10242 |
Chemical Identifiers
| CAS Number | 52999-15-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C#CCCO |
Product Overview
4-(4-Methoxyphenyl)but-3-yn-1-ol (CAS 52999-15-2), with molecular formula C11H12O2 and molecular weight 176.08 g/mol. IUPAC: 4-(4-methoxyphenyl)but-3-yn-1-ol.
Chemical Property Profile of 4-(4-Methoxyphenyl)but-3-yn-1-ol
Property Insights of 4-(4-Methoxyphenyl)but-3-yn-1-ol
The XLogP value of 1.4291 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Methoxyphenyl)but-3-yn-1-ol. With a topological polar surface area (TPSA) of 29.46 Ų, 4-(4-Methoxyphenyl)but-3-yn-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Methoxyphenyl)but-3-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 4-(4-Methoxyphenyl)but-3-yn-1-ol?
The CAS number of 4-(4-Methoxyphenyl)but-3-yn-1-ol is 52999-15-2.
What is the molecular formula of 4-(4-Methoxyphenyl)but-3-yn-1-ol?
The molecular formula of 4-(4-Methoxyphenyl)but-3-yn-1-ol is C11H12O2.
What is the molecular weight of 4-(4-Methoxyphenyl)but-3-yn-1-ol?
The molecular weight of 4-(4-Methoxyphenyl)but-3-yn-1-ol is 176.08 g/mol.
Where can I buy 4-(4-Methoxyphenyl)but-3-yn-1-ol?
You can request a quote for 4-(4-Methoxyphenyl)but-3-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 4-(4-Methoxyphenyl)but-3-yn-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Methoxyphenyl)but-3-yn-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.