5-Phenylpent-2-en-4-yn-1-ol
TL;DR: 5-Phenylpent-2-en-4-yn-1-ol (CAS 17733-79-8) is a chemical compound with molecular formula C11H10O and molecular weight 158.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenylpent-2-en-4-yn-1-ol
Also Known As: 5-phenyl-pent-2-en-4-yn-1-ol
| Molecular Formula | C11H10O |
|---|---|
| Molecular Weight | 158.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 158.07317 |
| Heavy Atoms | 12 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 17733-79-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C#CC=CCO |
| InChIKey | JSNIMQCVEHRHSB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Phenylpent-2-en-4-yn-1-ol (CAS 17733-79-8), with molecular formula C11H10O and molecular weight 158.07 g/mol. IUPAC: 5-phenylpent-2-en-4-yn-1-ol.
Chemical Property Profile of 5-Phenylpent-2-en-4-yn-1-ol
Property Insights of 5-Phenylpent-2-en-4-yn-1-ol
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Phenylpent-2-en-4-yn-1-ol. With a topological polar surface area (TPSA) of 20.2 Ų, 5-Phenylpent-2-en-4-yn-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Phenylpent-2-en-4-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 5-Phenylpent-2-en-4-yn-1-ol?
The CAS number of 5-Phenylpent-2-en-4-yn-1-ol is 17733-79-8.
What is the molecular formula of 5-Phenylpent-2-en-4-yn-1-ol?
The molecular formula of 5-Phenylpent-2-en-4-yn-1-ol is C11H10O.
What is the molecular weight of 5-Phenylpent-2-en-4-yn-1-ol?
The molecular weight of 5-Phenylpent-2-en-4-yn-1-ol is 158.07 g/mol.
Where can I buy 5-Phenylpent-2-en-4-yn-1-ol?
You can request a quote for 5-Phenylpent-2-en-4-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 5-Phenylpent-2-en-4-yn-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 5-Phenylpent-2-en-4-yn-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.