Methyl-isopropyl-phosphonofluoridate
TL;DR: Methyl-isopropyl-phosphonofluoridate (CAS 648-59-9) is a chemical compound with molecular formula C4H10FO2P and molecular weight 140.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[fluoro(methoxy)phosphoryl]propane
Also Known As: Methyl isopropylphosphonofluoridoate, methyl-isopropyl-phosphonofluoridate, 2-[fluoro(methoxy)phosphoryl]propane, Methyl propan-2-ylphosphonofluoridate, Methyl isopropylphosphonofluoridoate #
| Molecular Formula | C4H10FO2P |
|---|---|
| Molecular Weight | 140.04 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 140.04024 |
| Heavy Atoms | 8 |
| Complexity | 113.0 |
Chemical Identifiers
| CAS Number | 648-59-9 |
|---|---|
| SMILES | CC(C)P(=O)(OC)F |
| InChIKey | RAUQIHOMPUWDOK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl-isopropyl-phosphonofluoridate (CAS 648-59-9), with molecular formula C4H10FO2P and molecular weight 140.04 g/mol. IUPAC: 2-[fluoro(methoxy)phosphoryl]propane.
Chemical Property Profile of Methyl-isopropyl-phosphonofluoridate
Property Insights of Methyl-isopropyl-phosphonofluoridate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl-isopropyl-phosphonofluoridate. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl-isopropyl-phosphonofluoridate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl-isopropyl-phosphonofluoridate 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 Methyl-isopropyl-phosphonofluoridate?
The CAS number of Methyl-isopropyl-phosphonofluoridate is 648-59-9.
What is the molecular formula of Methyl-isopropyl-phosphonofluoridate?
The molecular formula of Methyl-isopropyl-phosphonofluoridate is C4H10FO2P.
What is the molecular weight of Methyl-isopropyl-phosphonofluoridate?
The molecular weight of Methyl-isopropyl-phosphonofluoridate is 140.04 g/mol.
Where can I buy Methyl-isopropyl-phosphonofluoridate?
You can request a quote for Methyl-isopropyl-phosphonofluoridate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl-isopropyl-phosphonofluoridate?
Yes, KEHONG BIO provides custom synthesis services for Methyl-isopropyl-phosphonofluoridate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.