4-Phenylbut-3-yn-1-ol
TL;DR: 4-Phenylbut-3-yn-1-ol (CAS 10229-11-5) is a chemical compound with molecular formula C10H10O and molecular weight 146.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-phenylbut-3-yn-1-ol
Also Known As: 4-Phenylbut-3-yn-1-ol, 4-Phenyl-3-butyn-1-ol, 3-Butyn-1-ol, 4-phenyl-, 4-Phenyl-but-3-yn-1-ol, 4-Phenyl-3-butin-1-ol
| Molecular Formula | C10H10O |
|---|---|
| Molecular Weight | 146.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 146.07317 |
| Heavy Atoms | 11 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 10229-11-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C#CCCO |
| InChIKey | IBHSROAJVVUWSC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Phenylbut-3-yn-1-ol (CAS 10229-11-5), with molecular formula C10H10O and molecular weight 146.07 g/mol. IUPAC: 4-phenylbut-3-yn-1-ol.
Chemical Property Profile of 4-Phenylbut-3-yn-1-ol
Property Insights of 4-Phenylbut-3-yn-1-ol
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Phenylbut-3-yn-1-ol. With a topological polar surface area (TPSA) of 20.2 Ų, 4-Phenylbut-3-yn-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Phenylbut-3-yn-1-ol has 1 hydrogen bond donor(s) and 1 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-Phenylbut-3-yn-1-ol?
The CAS number of 4-Phenylbut-3-yn-1-ol is 10229-11-5.
What is the molecular formula of 4-Phenylbut-3-yn-1-ol?
The molecular formula of 4-Phenylbut-3-yn-1-ol is C10H10O.
What is the molecular weight of 4-Phenylbut-3-yn-1-ol?
The molecular weight of 4-Phenylbut-3-yn-1-ol is 146.07 g/mol.
Where can I buy 4-Phenylbut-3-yn-1-ol?
You can request a quote for 4-Phenylbut-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-Phenylbut-3-yn-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 4-Phenylbut-3-yn-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.