1-Methylpropyl methylphosphonofluoridate
TL;DR: 1-Methylpropyl methylphosphonofluoridate (CAS 352-52-3) is a chemical compound with molecular formula C5H12FO2P and molecular weight 154.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[fluoro(methyl)phosphoryl]oxybutane
Also Known As: Sec-butyl methylphosphonofluoridate, 2-Butyl methylphosphonofluoridate, 1-Methylpropyl methylphosphonofluoridate, S-Butyl methylphosphonofluoridate, 2-[fluoro(methyl)phosphoryl]oxybutane
| Molecular Formula | C5H12FO2P |
|---|---|
| Molecular Weight | 154.06 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 154.0559 |
| Heavy Atoms | 9 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 352-52-3 |
|---|---|
| SMILES | CCC(C)OP(=O)(C)F |
| InChIKey | INIUKZAEJHEEFF-UHFFFAOYSA-N |
Product Overview
1-Methylpropyl methylphosphonofluoridate (CAS 352-52-3), with molecular formula C5H12FO2P and molecular weight 154.06 g/mol. IUPAC: 2-[fluoro(methyl)phosphoryl]oxybutane.
Chemical Property Profile of 1-Methylpropyl methylphosphonofluoridate
Property Insights of 1-Methylpropyl methylphosphonofluoridate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methylpropyl methylphosphonofluoridate. With a topological polar surface area (TPSA) of 26.3 Ų, 1-Methylpropyl methylphosphonofluoridate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methylpropyl methylphosphonofluoridate 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 1-Methylpropyl methylphosphonofluoridate?
The CAS number of 1-Methylpropyl methylphosphonofluoridate is 352-52-3.
What is the molecular formula of 1-Methylpropyl methylphosphonofluoridate?
The molecular formula of 1-Methylpropyl methylphosphonofluoridate is C5H12FO2P.
What is the molecular weight of 1-Methylpropyl methylphosphonofluoridate?
The molecular weight of 1-Methylpropyl methylphosphonofluoridate is 154.06 g/mol.
Where can I buy 1-Methylpropyl methylphosphonofluoridate?
You can request a quote for 1-Methylpropyl methylphosphonofluoridate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methylpropyl methylphosphonofluoridate?
Yes, KEHONG BIO provides custom synthesis services for 1-Methylpropyl methylphosphonofluoridate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.