5-(4-Hydroxybutyl)furan-2-carbaldehyde
TL;DR: 5-(4-Hydroxybutyl)furan-2-carbaldehyde (CAS 136518-16-6) is a chemical compound with molecular formula C9H12O3 and molecular weight 168.07864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(4-hydroxybutyl)furan-2-carbaldehyde
Also Known As: ICCB6_000020, 5-(4-hydroxybutyl)furan-2-carbaldehyde
Technical Specifications
| Molecular Formula | C9H12O3 |
| Molecular Weight | 168.07864 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 50.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 168.07864 Da |
| Heavy Atoms | 12 |
| Complexity | 136.0 |
| SMILES | C1=C(OC(=C1)C=O)CCCCO |
| InChIKey | DXJOFYSHALFRMN-UHFFFAOYSA-N |
Chemical Property Profile of 5-(4-Hydroxybutyl)furan-2-carbaldehyde
Property Insights of 5-(4-Hydroxybutyl)furan-2-carbaldehyde
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-Hydroxybutyl)furan-2-carbaldehyde. With a topological polar surface area (TPSA) of 50.4 Ų, 5-(4-Hydroxybutyl)furan-2-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-Hydroxybutyl)furan-2-carbaldehyde has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-(4-Hydroxybutyl)furan-2-carbaldehyde?
The CAS number of 5-(4-Hydroxybutyl)furan-2-carbaldehyde is 136518-16-6.
What is the molecular formula of 5-(4-Hydroxybutyl)furan-2-carbaldehyde?
The molecular formula of 5-(4-Hydroxybutyl)furan-2-carbaldehyde is C9H12O3.
What is the molecular weight of 5-(4-Hydroxybutyl)furan-2-carbaldehyde?
The molecular weight of 5-(4-Hydroxybutyl)furan-2-carbaldehyde is 168.07864 g/mol.
Where can I buy 5-(4-Hydroxybutyl)furan-2-carbaldehyde?
You can request a quote for 5-(4-Hydroxybutyl)furan-2-carbaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(4-Hydroxybutyl)furan-2-carbaldehyde?
Yes, CoreyChem provides custom synthesis services for 5-(4-Hydroxybutyl)furan-2-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.