甲氧氟烷
TL;DR: 甲氧氟烷 (CAS 76-38-0) is a chemical compound with molecular formula C3H4Cl2F2O and molecular weight 163.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲氧氟烷
2,2-dichloro-1,1-difluoro-1-methoxyethane
Also Known As: methoxyflurane, Methoxyfluran, Penthrane, Methoflurane, Anecotan
| Molecular Formula | C3H4Cl2F2O |
|---|---|
| Molecular Weight | 163.96 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.96072 |
| Heavy Atoms | 8 |
| Complexity | 75.0 |
| Melting Point | -35.0 °C |
| Boiling Point | 104.6 °C at 760 mmHg |
| Density | 1.426 at 20.0 °C |
| Solubility | less than 1 mg/mL at 66 °F (NTP, 1992) |
| Flash Point | 62.8 °C |
| Vapor Pressure | 20 mmHg at 17.7 °C ; 22.5 mmHg at 20.0 °C |
Chemical Identifiers
| CAS Number | 76-38-0 |
|---|---|
| SMILES | COC(C(Cl)Cl)(F)F |
| InChIKey | RFKMCNOHBTXSMU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲氧氟烷 (CAS 76-38-0), with molecular formula C3H4Cl2F2O and molecular weight 163.96 g/mol. IUPAC: 2,2-dichloro-1,1-difluoro-1-methoxyethane.
Chemical Property Profile of 甲氧氟烷
Property Insights of 甲氧氟烷
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 甲氧氟烷. With a topological polar surface area (TPSA) of 9.2 Ų, 甲氧氟烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲氧氟醚 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
Frequently Asked Questions
What is the CAS number of 甲氧氟醚?
The CAS number of 甲氧氟醚 is 76-38-0.
What is the molecular formula of 甲氧氟醚?
The molecular formula of 甲氧氟醚 is C3H4Cl2F2O.
What is the molecular weight of 甲氧氟醚?
The molecular weight of 甲氧氟醚 is 163.96 g/mol.
Where can I buy 甲氧氟醚?
You can request a quote for 甲氧氟醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲氧氟醚?
Yes, KEHONG BIO provides custom synthesis services for 甲氧氟醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.