2-Fluorophenylglyoxal hydrate
TL;DR: 2-Fluorophenylglyoxal hydrate (CAS 1049745-66-5) is a chemical compound with molecular formula C8H7FO3 and molecular weight 170.03792 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-fluorophenyl)-2-oxoacetaldehyde;hydrate
Also Known As: 2-fluorophenylglyoxal hydrate, 2-(2-fluorophenyl)-2-oxoacetaldehyde hydrate, Ethanone,1-(2-fluorophenyl)-2,2-dihydroxy-, 2-(2-fluorophenyl)-2-oxoacetaldehyde,hydrate, 2-(2-fluorophenyl)-2-oxoacetaldehyde;hydrate
Technical Specifications
| Molecular Formula | C8H7FO3 |
| Molecular Weight | 170.03792 g/mol |
| XLogP | 0.3826 |
| Topological Polar Surface Area (TPSA) | 35.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.03792 Da |
| Heavy Atoms | 12 |
| Complexity | 167.0 |
| SMILES | C1=CC=C(C(=C1)C(=O)C=O)F.O |
| InChIKey | SRFHVRGKWSAPSD-UHFFFAOYSA-N |
Chemical Property Profile of 2-Fluorophenylglyoxal hydrate
Property Insights of 2-Fluorophenylglyoxal hydrate
The XLogP value of 0.3826 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Fluorophenylglyoxal hydrate. With a topological polar surface area (TPSA) of 35.1 Ų, 2-Fluorophenylglyoxal hydrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Fluorophenylglyoxal hydrate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Fluorophenylglyoxal hydrate?
The CAS number of 2-Fluorophenylglyoxal hydrate is 1049745-66-5.
What is the molecular formula of 2-Fluorophenylglyoxal hydrate?
The molecular formula of 2-Fluorophenylglyoxal hydrate is C8H7FO3.
What is the molecular weight of 2-Fluorophenylglyoxal hydrate?
The molecular weight of 2-Fluorophenylglyoxal hydrate is 170.03792 g/mol.
Where can I buy 2-Fluorophenylglyoxal hydrate?
You can request a quote for 2-Fluorophenylglyoxal hydrate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Fluorophenylglyoxal hydrate?
Yes, CoreyChem provides custom synthesis services for 2-Fluorophenylglyoxal hydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.