![Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate structure](/static/products/2563/256332-94-2.webp)
Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate
TL;DR: Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate (CAS 256332-94-2) is a chemical compound with molecular formula C14H26F3O6P and molecular weight 378.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[bis(3-methylbutoxy)phosphoryloxy]-3,3,3-trifluoropropanoate
Also Known As: methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate, Methyl 2-((bis(isopentyloxy)phosphoryl)oxy)-3,3,3-trifluoropropanoate, methyl 2-[bis(3-methylbutoxy)phosphoryloxy]-3,3,3-trifluoropropanoate, Methyl 2-([bis(isopentyloxy)phosphoryl]oxy)-3,3,3-trifluoropropanoate #, methyl 2-{[bis(3-methylbutoxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate
| Molecular Formula | C14H26F3O6P |
|---|---|
| Molecular Weight | 378.14 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 378.1419 |
| Heavy Atoms | 24 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 256332-94-2 |
|---|---|
| SMILES | CC(C)CCOP(=O)(OCCC(C)C)OC(C(=O)OC)C(F)(F)F |
| InChIKey | IIRNAJFYLMYZSO-UHFFFAOYSA-N |
Product Overview
Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate (CAS 256332-94-2), with molecular formula C14H26F3O6P and molecular weight 378.14 g/mol. IUPAC: methyl 2-[bis(3-methylbutoxy)phosphoryloxy]-3,3,3-trifluoropropanoate.
Chemical Property Profile of Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate
Property Insights of Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate
The XLogP value of 4.0 indicates that Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate. Following Lipinski's Rule of Five, Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate has 0 hydrogen bond donor(s) and 9 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 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate?
The CAS number of Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate is 256332-94-2.
What is the molecular formula of Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate?
The molecular formula of Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate is C14H26F3O6P.
What is the molecular weight of Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate?
The molecular weight of Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate is 378.14 g/mol.
Where can I buy Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate?
You can request a quote for Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-{[di(isopentyloxy)phosphoryl]oxy}-3,3,3-trifluoropropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.