5-(2-Furyl)isoxazole-3-carbaldehyde
TL;DR: 5-(2-Furyl)isoxazole-3-carbaldehyde (CAS 852180-62-2) is a chemical compound with molecular formula C8H5NO3 and molecular weight 163.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(furan-2-yl)-1,2-oxazole-3-carbaldehyde
Also Known As: 5-(2-furyl)isoxazole-3-carbaldehyde, 5-(furan-2-yl)-1,2-oxazole-3-carbaldehyde, 3-Isoxazolecarboxaldehyde,5-(2-furanyl)-, 5-(Furan-2-yl)isoxazole-3-carbaldehyde, (3-piperidylphenyl)methan-1-ol
| Molecular Formula | C8H5NO3 |
|---|---|
| Molecular Weight | 163.03 g/mol |
| LogP | 1.7471 |
| Topological Polar Surface Area | 56.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.02695 |
| Heavy Atoms | 12 |
| Complexity | 374.67325 |
Chemical Identifiers
| CAS Number | 852180-62-2 |
|---|---|
| SMILES | C1=COC(=C1)C2=CC(=NO2)C=O |
Product Overview
5-(2-Furyl)isoxazole-3-carbaldehyde (CAS 852180-62-2), with molecular formula C8H5NO3 and molecular weight 163.03 g/mol. IUPAC: 5-(furan-2-yl)-1,2-oxazole-3-carbaldehyde.
Chemical Property Profile of 5-(2-Furyl)isoxazole-3-carbaldehyde
Property Insights of 5-(2-Furyl)isoxazole-3-carbaldehyde
The XLogP value of 1.7471 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-Furyl)isoxazole-3-carbaldehyde. With a topological polar surface area (TPSA) of 56.24 Ų, 5-(2-Furyl)isoxazole-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(2-Furyl)isoxazole-3-carbaldehyde has 0 hydrogen bond donor(s) and 4 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-(2-Furyl)isoxazole-3-carbaldehyde?
The CAS number of 5-(2-Furyl)isoxazole-3-carbaldehyde is 852180-62-2.
What is the molecular formula of 5-(2-Furyl)isoxazole-3-carbaldehyde?
The molecular formula of 5-(2-Furyl)isoxazole-3-carbaldehyde is C8H5NO3.
What is the molecular weight of 5-(2-Furyl)isoxazole-3-carbaldehyde?
The molecular weight of 5-(2-Furyl)isoxazole-3-carbaldehyde is 163.03 g/mol.
Where can I buy 5-(2-Furyl)isoxazole-3-carbaldehyde?
You can request a quote for 5-(2-Furyl)isoxazole-3-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-Furyl)isoxazole-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-Furyl)isoxazole-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.