Methoxyflurane
TL;DR: Methoxyflurane (CAS 76-38-0) is a chemical compound with molecular formula C3H4Cl2F2O and molecular weight 163.96072 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2-dichloro-1,1-difluoro-1-methoxyethane
Also Known As: methoxyflurane, Methoxyfluran, Penthrane, Methoflurane, Anecotan
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C3H4Cl2F2O |
| Molecular Weight | 163.96072 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.96072 Da |
| Heavy Atoms | 8 |
| Complexity | 75.0 |
| Melting Point | -31 °F (NTP, 1992) |
| Boiling Point | 220.3 °F at 760 mmHg (NTP, 1992) |
| Density | 1.426 at 68 °F (NTP, 1992) - Denser than water; will sink |
| Flash Point | 145 °F (NTP, 1992) |
| Vapor Pressure | 20 mmHg at 63.9 °F ; 22.5 mmHg at 68 °F (NTP, 1992) |
| Solubility | less than 1 mg/mL at 66 °F (NTP, 1992) |
| SMILES | COC(C(Cl)Cl)(F)F |
| InChIKey | RFKMCNOHBTXSMU-UHFFFAOYSA-N |
Product Description
Applications: Methoxyflurane is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A pharmaceutical intermediate supplied by CoreyChem, Methoxyflurane (CAS 76-38-0) has the molecular formula C3H4Cl2F2O and a molecular weight of 163.96 g/mol. Reported properties include a density of 1.426 at 68 °F (NTP, 1992) - Denser than water; will sink g/cm³, a solubility: less than 1 mg/mL at 66 °F (NTP, 1992). Synonyms include methoxyflurane and Methoxyfluran.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Methoxyflurane
Property Insights of Methoxyflurane
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methoxyflurane. With a topological polar surface area (TPSA) of 9.2 Ų, Methoxyflurane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methoxyflurane 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 Methoxyflurane?
The CAS number of Methoxyflurane is 76-38-0.
What is the molecular formula of Methoxyflurane?
The molecular formula of Methoxyflurane is C3H4Cl2F2O.
What is the molecular weight of Methoxyflurane?
The molecular weight of Methoxyflurane is 163.96072 g/mol.
What are the applications of Methoxyflurane?
Methoxyflurane is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to...
Where can I buy Methoxyflurane?
You can request a quote for Methoxyflurane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methoxyflurane?
Yes, CoreyChem provides custom synthesis services for Methoxyflurane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.