Diethylmalonyl dichloride
TL;DR: Diethylmalonyl dichloride (CAS 54505-72-5) is a chemical compound with molecular formula C7H10Cl2O2 and molecular weight 196.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-diethylpropanedioyl dichloride
Also Known As: Diethylmalonyl dichloride, Diathylmalonylchlorid, 2,2-diethylpropanedioyl Dichloride, Diethylmalonic acid dichloride, diethylmalonyl chloride
| Molecular Formula | C7H10Cl2O2 |
|---|---|
| Molecular Weight | 196.01 g/mol |
| LogP | 2.3236 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.00578 |
| Heavy Atoms | 11 |
| Complexity | 157.27939 |
Chemical Identifiers
| CAS Number | 54505-72-5 |
|---|---|
| SMILES | CCC(CC)(C(=O)Cl)C(=O)Cl |
Product Overview
Diethylmalonyl dichloride (CAS 54505-72-5), with molecular formula C7H10Cl2O2 and molecular weight 196.01 g/mol. IUPAC: 2,2-diethylpropanedioyl dichloride.
Chemical Property Profile of Diethylmalonyl dichloride
Property Insights of Diethylmalonyl dichloride
The XLogP value of 2.3236 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethylmalonyl dichloride. With a topological polar surface area (TPSA) of 34.14 Ų, Diethylmalonyl dichloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethylmalonyl dichloride 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 Diethylmalonyl dichloride?
The CAS number of Diethylmalonyl dichloride is 54505-72-5.
What is the molecular formula of Diethylmalonyl dichloride?
The molecular formula of Diethylmalonyl dichloride is C7H10Cl2O2.
What is the molecular weight of Diethylmalonyl dichloride?
The molecular weight of Diethylmalonyl dichloride is 196.01 g/mol.
Where can I buy Diethylmalonyl dichloride?
You can request a quote for Diethylmalonyl dichloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethylmalonyl dichloride?
Yes, KEHONG BIO provides custom synthesis services for Diethylmalonyl dichloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.