二异丙基氟磷酸盐
TL;DR: 二异丙基氟磷酸盐 (CAS 55-91-4) is a chemical compound with molecular formula C6H14FO3P and molecular weight 184.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二异丙基氟磷酸盐
2-[fluoro(propan-2-yloxy)phosphoryl]oxypropane
Also Known As: Isoflurophate, diisopropyl fluorophosphate, Fluostigmine, Isofluorphate, Neoglaucit
| Molecular Formula | C6H14FO3P |
|---|---|
| Molecular Weight | 184.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 184.06645 |
| Heavy Atoms | 11 |
| Complexity | 144.0 |
| Melting Point | -82.2 °C |
| Boiling Point | 62.2 °C at 9 mmHg |
| Density | 1.055 |
| Solubility | 15400 |
| Vapor Pressure | 0.579 mmHg at 20.0 °C |
| Refractive Index | 1.3830 @ 25 °C |
Chemical Identifiers
| CAS Number | 55-91-4 |
|---|---|
| SMILES | CC(C)OP(=O)(OC(C)C)F |
| InChIKey | MUCZHBLJLSDCSD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二异丙基氟磷酸盐 (CAS 55-91-4), with molecular formula C6H14FO3P and molecular weight 184.07 g/mol. IUPAC: 2-[fluoro(propan-2-yloxy)phosphoryl]oxypropane.
Chemical Property Profile of 二异丙基氟磷酸盐
Property Insights of 二异丙基氟磷酸盐
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二异丙基氟磷酸盐. With a topological polar surface area (TPSA) of 35.5 Ų, 二异丙基氟磷酸盐 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二异丙基氟磷酸盐 has 0 hydrogen bond donor(s) and 4 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 二异丙基氟磷酸盐?
The CAS number of 二异丙基氟磷酸盐 is 55-91-4.
What is the molecular formula of 二异丙基氟磷酸盐?
The molecular formula of 二异丙基氟磷酸盐 is C6H14FO3P.
What is the molecular weight of 二异丙基氟磷酸盐?
The molecular weight of 二异丙基氟磷酸盐 is 184.07 g/mol.
Where can I buy 二异丙基氟磷酸盐?
You can request a quote for 二异丙基氟磷酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二异丙基氟磷酸盐?
Yes, KEHONG BIO provides custom synthesis services for 二异丙基氟磷酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.