Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate
TL;DR: Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate (CAS 6011-33-2) is a chemical compound with molecular formula C18H16Cl2O5 and molecular weight 382.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[[5-(2,4-dichlorophenyl)furan-2-yl]methylidene]propanedioate
Also Known As: BIM-0040539.P001, UPCMLD0ENAT0502-4725:001, diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate, diethyl {[5-(2,4-dichlorophenyl)furan-2-yl]methylidene}propanedioate, diethyl 2-[[5-(2,4-dichlorophenyl)furan-2-yl]methylidene]propanedioate
| Molecular Formula | C18H16Cl2O5 |
|---|---|
| Molecular Weight | 382.04 g/mol |
| LogP | 4.763 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.03748 |
| Heavy Atoms | 25 |
| Complexity | 787.5478 |
Chemical Identifiers
| CAS Number | 6011-33-2 |
|---|---|
| SMILES | CCOC(=O)C(=CC1=CC=C(O1)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC |
Product Overview
Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate (CAS 6011-33-2), with molecular formula C18H16Cl2O5 and molecular weight 382.04 g/mol. IUPAC: diethyl 2-[[5-(2,4-dichlorophenyl)furan-2-yl]methylidene]propanedioate.
Chemical Property Profile of Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate
Property Insights of Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate
The XLogP value of 4.763 indicates that Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate. Following Lipinski's Rule of Five, Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate 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 Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate?
The CAS number of Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate is 6011-33-2.
What is the molecular formula of Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate?
The molecular formula of Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate is C18H16Cl2O5.
What is the molecular weight of Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate?
The molecular weight of Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate is 382.04 g/mol.
Where can I buy Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate?
You can request a quote for Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl {[5-(2,4-dichlorophenyl)-2-furyl]methylene}malonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.