(3,3-Dichlorooxan-2-yl) formate
TL;DR: (3,3-Dichlorooxan-2-yl) formate (CAS 141942-53-2) is a chemical compound with molecular formula C6H8Cl2O3 and molecular weight 197.98505 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,3-dichlorooxan-2-yl) formate
Also Known As: (3,3-dichlorooxan-2-yl) formate, 3,3-DICHLORO-2-FORMOXYTETRAHYDROPYRAN, 1-Chloro-7-methylisoquinoline, 3,3-DICHLOROOXAN-2-YL FORMATE, 2H-Pyran-2-ol,3,3-dichlorotetrahydro-, 2-formate
Technical Specifications
| Molecular Formula | C6H8Cl2O3 |
| Molecular Weight | 197.98505 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 197.98505 Da |
| Heavy Atoms | 11 |
| Complexity | 149.0 |
| SMILES | C1CC(C(OC1)OC=O)(Cl)Cl |
| InChIKey | RJZSBBQFYWZFDG-UHFFFAOYSA-N |
Chemical Property Profile of (3,3-Dichlorooxan-2-yl) formate
Property Insights of (3,3-Dichlorooxan-2-yl) formate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,3-Dichlorooxan-2-yl) formate. With a topological polar surface area (TPSA) of 35.5 Ų, (3,3-Dichlorooxan-2-yl) formate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3,3-Dichlorooxan-2-yl) formate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (3,3-Dichlorooxan-2-yl) formate?
The CAS number of (3,3-Dichlorooxan-2-yl) formate is 141942-53-2.
What is the molecular formula of (3,3-Dichlorooxan-2-yl) formate?
The molecular formula of (3,3-Dichlorooxan-2-yl) formate is C6H8Cl2O3.
What is the molecular weight of (3,3-Dichlorooxan-2-yl) formate?
The molecular weight of (3,3-Dichlorooxan-2-yl) formate is 197.98505 g/mol.
Where can I buy (3,3-Dichlorooxan-2-yl) formate?
You can request a quote for (3,3-Dichlorooxan-2-yl) formate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3,3-Dichlorooxan-2-yl) formate?
Yes, CoreyChem provides custom synthesis services for (3,3-Dichlorooxan-2-yl) formate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.