(4-Methoxyphenyl)glyoxal
TL;DR: (4-Methoxyphenyl)glyoxal (CAS 1076-95-5) is a chemical compound with molecular formula C9H8O3 and molecular weight 164.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methoxyphenyl)-2-oxoacetaldehyde
Also Known As: 2-(4-Methoxyphenyl)-2-oxoacetaldehyde, 4-Methoxyphenylglyoxal, p-Anisoylglyoxal, (p-Methoxyphenyl)glyoxal, 4-Methoxyphenylethanedione
| Molecular Formula | C9H8O3 |
|---|---|
| Molecular Weight | 164.05 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 164.04735 |
| Heavy Atoms | 12 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 1076-95-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)C=O |
| InChIKey | LNZBSIXPXJKKDF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(4-Methoxyphenyl)glyoxal (CAS 1076-95-5), with molecular formula C9H8O3 and molecular weight 164.05 g/mol. IUPAC: 2-(4-methoxyphenyl)-2-oxoacetaldehyde.
Chemical Property Profile of (4-Methoxyphenyl)glyoxal
Property Insights of (4-Methoxyphenyl)glyoxal
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Methoxyphenyl)glyoxal. With a topological polar surface area (TPSA) of 43.4 Ų, (4-Methoxyphenyl)glyoxal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Methoxyphenyl)glyoxal has 0 hydrogen bond donor(s) and 3 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 (4-Methoxyphenyl)glyoxal?
The CAS number of (4-Methoxyphenyl)glyoxal is 1076-95-5.
What is the molecular formula of (4-Methoxyphenyl)glyoxal?
The molecular formula of (4-Methoxyphenyl)glyoxal is C9H8O3.
What is the molecular weight of (4-Methoxyphenyl)glyoxal?
The molecular weight of (4-Methoxyphenyl)glyoxal is 164.05 g/mol.
Where can I buy (4-Methoxyphenyl)glyoxal?
You can request a quote for (4-Methoxyphenyl)glyoxal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Methoxyphenyl)glyoxal?
Yes, KEHONG BIO provides custom synthesis services for (4-Methoxyphenyl)glyoxal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.