Dimethyl 2,3-dichlorosuccinate
TL;DR: Dimethyl 2,3-dichlorosuccinate (CAS 62173-55-1) is a chemical compound with molecular formula C6H8Cl2O4 and molecular weight 213.97997 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl 2,3-dichlorobutanedioate
Also Known As: Dimethyl 2,3-dichlorosuccinate, dimethyl 2,3-dichlorobutanedioate, Dimethyl2,3-dichlorosuccinate, TL 126, Butanedioic acid, 2,3-dichloro-, dimethyl ester
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H8Cl2O4 |
| Molecular Weight | 213.97997 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 213.97997 Da |
| Heavy Atoms | 12 |
| Complexity | 162.0 |
| SMILES | COC(=O)C(C(C(=O)OC)Cl)Cl |
| InChIKey | JBNBHRIGUASWJK-UHFFFAOYSA-N |
Chemical Property Profile of Dimethyl 2,3-dichlorosuccinate
Property Insights of Dimethyl 2,3-dichlorosuccinate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 2,3-dichlorosuccinate. With a topological polar surface area (TPSA) of 52.6 Ų, Dimethyl 2,3-dichlorosuccinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl 2,3-dichlorosuccinate 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
What is the CAS number of Dimethyl 2,3-dichlorosuccinate?
The CAS number of Dimethyl 2,3-dichlorosuccinate is 62173-55-1.
What is the molecular formula of Dimethyl 2,3-dichlorosuccinate?
The molecular formula of Dimethyl 2,3-dichlorosuccinate is C6H8Cl2O4.
What is the molecular weight of Dimethyl 2,3-dichlorosuccinate?
The molecular weight of Dimethyl 2,3-dichlorosuccinate is 213.97997 g/mol.
Where can I buy Dimethyl 2,3-dichlorosuccinate?
You can request a quote for Dimethyl 2,3-dichlorosuccinate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dimethyl 2,3-dichlorosuccinate?
Yes, CoreyChem provides custom synthesis services for Dimethyl 2,3-dichlorosuccinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.