Dichloroisoflurane
TL;DR: Dichloroisoflurane (CAS 1263284-59-8) is a chemical compound with molecular formula C3Cl3F5O and molecular weight 251.8935 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1-dichloro-1-[chloro(difluoro)methoxy]-2,2,2-trifluoroethane
Also Known As: Dichloroisoflurane, 1,1-Dichloro-2,2,2-trifluoroethyl chlorodifluoromethyl ether, Dichloroisoflurane [USP], Isofluorane Impurity 2, 1,1-dichloro-1-(chlorodifluoromethoxy)-2,2,2-trifluoroethane
Technical Specifications
| Molecular Formula | C3Cl3F5O |
| Molecular Weight | 251.8935 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.8935 Da |
| Heavy Atoms | 12 |
| Complexity | 166.0 |
| SMILES | C(C(F)(F)F)(OC(F)(F)Cl)(Cl)Cl |
| InChIKey | QPYZGZHEKIQPIC-UHFFFAOYSA-N |
Chemical Property Profile of Dichloroisoflurane
Property Insights of Dichloroisoflurane
The XLogP value of 3.9 indicates that Dichloroisoflurane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Dichloroisoflurane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dichloroisoflurane has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Dichloroisoflurane?
The CAS number of Dichloroisoflurane is 1263284-59-8.
What is the molecular formula of Dichloroisoflurane?
The molecular formula of Dichloroisoflurane is C3Cl3F5O.
What is the molecular weight of Dichloroisoflurane?
The molecular weight of Dichloroisoflurane is 251.8935 g/mol.
Where can I buy Dichloroisoflurane?
You can request a quote for Dichloroisoflurane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dichloroisoflurane?
Yes, CoreyChem provides custom synthesis services for Dichloroisoflurane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.