![3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde structure](/static/products/5000/500018-47-3.webp)
3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde
TL;DR: 3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde (CAS 500018-47-3) is a chemical compound with molecular formula C12H8ClFN2O3 and molecular weight 282.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chloro-5-fluoropyrimidin-4-yl)oxy-4-methoxybenzaldehyde
Also Known As: 3-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde, BAS 05492732, 3-(2-chloro-5-fluoropyrimidin-4-yl)oxy-4-methoxybenzaldehyde, 3-[(2-chloro-5-fluoro-4-pyrimidinyl)oxy]-4-methoxybenzaldehyde, AP-828/40995298
| Molecular Formula | C12H8ClFN2O3 |
|---|---|
| Molecular Weight | 282.02 g/mol |
| LogP | 2.8825 |
| Topological Polar Surface Area | 61.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 282.02075 |
| Heavy Atoms | 19 |
| Complexity | 621.91864 |
Chemical Identifiers
| CAS Number | 500018-47-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C=O)OC2=NC(=NC=C2F)Cl |
Product Overview
3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde (CAS 500018-47-3), with molecular formula C12H8ClFN2O3 and molecular weight 282.02 g/mol. IUPAC: 3-(2-chloro-5-fluoropyrimidin-4-yl)oxy-4-methoxybenzaldehyde.
Chemical Property Profile of 3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde
Property Insights of 3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde
The XLogP value of 2.8825 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde. The TPSA of 61.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde. Following Lipinski's Rule of Five, 3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde has 0 hydrogen bond donor(s) and 5 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-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde?
The CAS number of 3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde is 500018-47-3.
What is the molecular formula of 3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde?
The molecular formula of 3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde is C12H8ClFN2O3.
What is the molecular weight of 3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde?
The molecular weight of 3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde is 282.02 g/mol.
Where can I buy 3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde?
You can request a quote for 3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-[(2-Chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.