Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate
TL;DR: Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate (CAS 58747-66-3) is a chemical compound with molecular formula C12H9Cl2NO4 and molecular weight 300.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate
Also Known As: dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate, 6,8-dichloro-indolizine-1,2-dicarboxylic acid dimethyl ester
| Molecular Formula | C12H9Cl2NO4 |
|---|---|
| Molecular Weight | 300.99 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 57.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.99088 |
| Heavy Atoms | 19 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 58747-66-3 |
|---|---|
| SMILES | COC(=O)C1=CN2C=C(C=C(C2=C1C(=O)OC)Cl)Cl |
| InChIKey | NWPZGDJERLZUHZ-UHFFFAOYSA-N |
Product Overview
Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate (CAS 58747-66-3), with molecular formula C12H9Cl2NO4 and molecular weight 300.99 g/mol. IUPAC: dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate.
Chemical Property Profile of Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate
Property Insights of Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate
The XLogP value of 3.5 indicates that Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.0 Ų, Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate has 0 hydrogen bond donor(s) and 4 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 Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate?
The CAS number of Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate is 58747-66-3.
What is the molecular formula of Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate?
The molecular formula of Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate is C12H9Cl2NO4.
What is the molecular weight of Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate?
The molecular weight of Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate is 300.99 g/mol.
Where can I buy Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate?
You can request a quote for Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.