1-Phenyl-1-penten-4-YN-3-OL
TL;DR: 1-Phenyl-1-penten-4-YN-3-OL (CAS 129646-83-9) 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.
1-phenylpent-1-en-4-yn-3-ol
Also Known As: 1-phenylpent-1-en-4-yn-3-ol, 4-aminobenzylformamide, 1-PHENYL-1-PENTEN-4-YN-3-OL, phenylpent-1-en-4-yn-3-ol, 1-Penten-4-yn-3-ol,1-phenyl-
| Molecular Formula | C11H10O |
|---|---|
| Molecular Weight | 158.07 g/mol |
| LogP | 2.0 |
| 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 | 190.0 |
Chemical Identifiers
| CAS Number | 129646-83-9 |
|---|---|
| SMILES | C#CC(C=CC1=CC=CC=C1)O |
| InChIKey | FZGJGBSLOXLHAL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Phenyl-1-penten-4-YN-3-OL (CAS 129646-83-9), with molecular formula C11H10O and molecular weight 158.07 g/mol. IUPAC: 1-phenylpent-1-en-4-yn-3-ol.
Chemical Property Profile of 1-Phenyl-1-penten-4-YN-3-OL
Property Insights of 1-Phenyl-1-penten-4-YN-3-OL
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenyl-1-penten-4-YN-3-OL. With a topological polar surface area (TPSA) of 20.2 Ų, 1-Phenyl-1-penten-4-YN-3-OL exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-1-penten-4-YN-3-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 1-Phenyl-1-penten-4-YN-3-OL?
The CAS number of 1-Phenyl-1-penten-4-YN-3-OL is 129646-83-9.
What is the molecular formula of 1-Phenyl-1-penten-4-YN-3-OL?
The molecular formula of 1-Phenyl-1-penten-4-YN-3-OL is C11H10O.
What is the molecular weight of 1-Phenyl-1-penten-4-YN-3-OL?
The molecular weight of 1-Phenyl-1-penten-4-YN-3-OL is 158.07 g/mol.
Where can I buy 1-Phenyl-1-penten-4-YN-3-OL?
You can request a quote for 1-Phenyl-1-penten-4-YN-3-OL directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-1-penten-4-YN-3-OL?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-1-penten-4-YN-3-OL and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.