3-(Furan-2-yl)-2-phenylacrylaldehyde
TL;DR: 3-(Furan-2-yl)-2-phenylacrylaldehyde (CAS 57568-60-2) is a chemical compound with molecular formula C13H10O2 and molecular weight 198.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(furan-2-yl)-2-phenylprop-2-enal
Also Known As: Spicy acrolein, 3-(2-FURYL)-2-PHENYLPROPENAL, alpha-Phenyl-2-furanacrolein, 3-(Furan-2-yl)-2-phenylacrylaldehyde, FEMA No. 3586
| Molecular Formula | C13H10O2 |
|---|---|
| Molecular Weight | 198.07 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 30.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.06808 |
| Heavy Atoms | 15 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 57568-60-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=CC2=CC=CO2)C=O |
| InChIKey | JPESOGFYFXAURP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Furan-2-yl)-2-phenylacrylaldehyde (CAS 57568-60-2), with molecular formula C13H10O2 and molecular weight 198.07 g/mol. IUPAC: 3-(furan-2-yl)-2-phenylprop-2-enal.
Chemical Property Profile of 3-(Furan-2-yl)-2-phenylacrylaldehyde
Property Insights of 3-(Furan-2-yl)-2-phenylacrylaldehyde
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Furan-2-yl)-2-phenylacrylaldehyde. With a topological polar surface area (TPSA) of 30.2 Ų, 3-(Furan-2-yl)-2-phenylacrylaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Furan-2-yl)-2-phenylacrylaldehyde has 0 hydrogen bond donor(s) and 2 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 3-(Furan-2-yl)-2-phenylacrylaldehyde?
The CAS number of 3-(Furan-2-yl)-2-phenylacrylaldehyde is 57568-60-2.
What is the molecular formula of 3-(Furan-2-yl)-2-phenylacrylaldehyde?
The molecular formula of 3-(Furan-2-yl)-2-phenylacrylaldehyde is C13H10O2.
What is the molecular weight of 3-(Furan-2-yl)-2-phenylacrylaldehyde?
The molecular weight of 3-(Furan-2-yl)-2-phenylacrylaldehyde is 198.07 g/mol.
Where can I buy 3-(Furan-2-yl)-2-phenylacrylaldehyde?
You can request a quote for 3-(Furan-2-yl)-2-phenylacrylaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Furan-2-yl)-2-phenylacrylaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-(Furan-2-yl)-2-phenylacrylaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.