Isobutyl methylphosphinate
TL;DR: Isobutyl methylphosphinate (CAS 25296-66-6) is a chemical compound with molecular formula C5H12O2P+ and molecular weight 135.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl-(2-methylpropoxy)-oxophosphanium
Also Known As: Isobutyl methylphosphinate, Methylphosphinsaureisobutylester, 2-methylpropyl methylphosphinate, EINECS 246-797-0, methyl-(2-methylpropoxy)-oxophosphanium
| Molecular Formula | C5H12O2P+ |
|---|---|
| Molecular Weight | 135.06 g/mol |
| LogP | 2.0312 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 135.0575 |
| Heavy Atoms | 8 |
| Complexity | 80.497856 |
Chemical Identifiers
| CAS Number | 25296-66-6 |
|---|---|
| SMILES | CC(C)CO[P+](=O)C |
Product Overview
Isobutyl methylphosphinate (CAS 25296-66-6), with molecular formula C5H12O2P+ and molecular weight 135.06 g/mol. IUPAC: methyl-(2-methylpropoxy)-oxophosphanium.
Chemical Property Profile of Isobutyl methylphosphinate
Property Insights of Isobutyl methylphosphinate
The XLogP value of 2.0312 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isobutyl methylphosphinate. With a topological polar surface area (TPSA) of 26.3 Ų, Isobutyl methylphosphinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isobutyl methylphosphinate has 0 hydrogen bond donor(s) and 2 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 Isobutyl methylphosphinate?
The CAS number of Isobutyl methylphosphinate is 25296-66-6.
What is the molecular formula of Isobutyl methylphosphinate?
The molecular formula of Isobutyl methylphosphinate is C5H12O2P+.
What is the molecular weight of Isobutyl methylphosphinate?
The molecular weight of Isobutyl methylphosphinate is 135.06 g/mol.
Where can I buy Isobutyl methylphosphinate?
You can request a quote for Isobutyl methylphosphinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isobutyl methylphosphinate?
Yes, KEHONG BIO provides custom synthesis services for Isobutyl methylphosphinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.