2-(3-Phenyl-1-propyn-1-yl)furan
TL;DR: 2-(3-Phenyl-1-propyn-1-yl)furan (CAS 5449-92-3) is a chemical compound with molecular formula C13H10O and molecular weight 182.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-phenylprop-1-ynyl)furan
Also Known As: Carlina oxide, 2-(3-phenylprop-1-ynyl)furan, 2-(3-phenylprop-1-yn-1-yl)furan, benzyl 2-furylacetylene, Furan, 2-(3-phenyl-1-propynyl)-
| Molecular Formula | C13H10O |
|---|---|
| Molecular Weight | 182.07 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 182.07317 |
| Heavy Atoms | 14 |
| Complexity | 226.0 |
Chemical Identifiers
| CAS Number | 5449-92-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC#CC2=CC=CO2 |
| InChIKey | ICRHFCVRNWSKQH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(3-Phenyl-1-propyn-1-yl)furan (CAS 5449-92-3), with molecular formula C13H10O and molecular weight 182.07 g/mol. IUPAC: 2-(3-phenylprop-1-ynyl)furan.
Chemical Property Profile of 2-(3-Phenyl-1-propyn-1-yl)furan
Property Insights of 2-(3-Phenyl-1-propyn-1-yl)furan
The XLogP value of 3.3 indicates that 2-(3-Phenyl-1-propyn-1-yl)furan is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 13.1 Ų, 2-(3-Phenyl-1-propyn-1-yl)furan exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Phenyl-1-propyn-1-yl)furan has 0 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 2-(3-Phenyl-1-propyn-1-yl)furan?
The CAS number of 2-(3-Phenyl-1-propyn-1-yl)furan is 5449-92-3.
What is the molecular formula of 2-(3-Phenyl-1-propyn-1-yl)furan?
The molecular formula of 2-(3-Phenyl-1-propyn-1-yl)furan is C13H10O.
What is the molecular weight of 2-(3-Phenyl-1-propyn-1-yl)furan?
The molecular weight of 2-(3-Phenyl-1-propyn-1-yl)furan is 182.07 g/mol.
Where can I buy 2-(3-Phenyl-1-propyn-1-yl)furan?
You can request a quote for 2-(3-Phenyl-1-propyn-1-yl)furan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Phenyl-1-propyn-1-yl)furan?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Phenyl-1-propyn-1-yl)furan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.