Aliflurane
TL;DR: Aliflurane (CAS 56689-41-9) is a chemical compound with molecular formula C4H3ClF4O and molecular weight 177.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-1,2,2,3-tetrafluoro-3-methoxycyclopropane
Also Known As: Aliflurano, Alifluranum, Aliflurane [USAN:INN], Alifluranum [INN-Latin], Aliflurano [INN-Spanish]
| Molecular Formula | C4H3ClF4O |
|---|---|
| Molecular Weight | 177.98 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 177.98085 |
| Heavy Atoms | 10 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 56689-41-9 |
|---|---|
| SMILES | COC1(C(C1(F)Cl)(F)F)F |
| InChIKey | LZKANMYVPJZLEW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Aliflurane (CAS 56689-41-9), with molecular formula C4H3ClF4O and molecular weight 177.98 g/mol. IUPAC: 1-chloro-1,2,2,3-tetrafluoro-3-methoxycyclopropane.
Chemical Property Profile of Aliflurane
Property Insights of Aliflurane
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aliflurane. With a topological polar surface area (TPSA) of 9.2 Ų, Aliflurane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aliflurane has 0 hydrogen bond donor(s) and 5 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 Aliflurane?
The CAS number of Aliflurane is 56689-41-9.
What is the molecular formula of Aliflurane?
The molecular formula of Aliflurane is C4H3ClF4O.
What is the molecular weight of Aliflurane?
The molecular weight of Aliflurane is 177.98 g/mol.
Where can I buy Aliflurane?
You can request a quote for Aliflurane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aliflurane?
Yes, KEHONG BIO provides custom synthesis services for Aliflurane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.