Ethylglyoxal
TL;DR: Ethylglyoxal (CAS 4417-81-6) is a chemical compound with molecular formula C4H6O2 and molecular weight 86.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-oxobutanal
Also Known As: 2-oxobutanal, Butanal, 2-oxo-, Ethylglyoxal, 2-OXOBUTANALDEHYDE, 1,2-butanedione
| Molecular Formula | C4H6O2 |
|---|---|
| Molecular Weight | 86.04 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 86.03678 |
| Heavy Atoms | 6 |
| Complexity | 65.0 |
Chemical Identifiers
| CAS Number | 4417-81-6 |
|---|---|
| SMILES | CCC(=O)C=O |
| InChIKey | RWHQMRRVZJSKGX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethylglyoxal (CAS 4417-81-6), with molecular formula C4H6O2 and molecular weight 86.04 g/mol. IUPAC: 2-oxobutanal.
Chemical Property Profile of Ethylglyoxal
Property Insights of Ethylglyoxal
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethylglyoxal. With a topological polar surface area (TPSA) of 34.1 Ų, Ethylglyoxal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethylglyoxal 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 Ethylglyoxal?
The CAS number of Ethylglyoxal is 4417-81-6.
What is the molecular formula of Ethylglyoxal?
The molecular formula of Ethylglyoxal is C4H6O2.
What is the molecular weight of Ethylglyoxal?
The molecular weight of Ethylglyoxal is 86.04 g/mol.
Where can I buy Ethylglyoxal?
You can request a quote for Ethylglyoxal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethylglyoxal?
Yes, KEHONG BIO provides custom synthesis services for Ethylglyoxal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.