Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate
TL;DR: Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate (CAS 108682-53-7) is a chemical compound with molecular formula C12H22F3O6P and molecular weight 350.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-dibutoxyphosphoryloxy-3,3,3-trifluoropropanoate
Also Known As: 3,3,3-Trifluorolactic acid methyl ester dibutyl phosphate, Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate, Propanoic acid, 3-((dibutoxyphosphinyl)oxy)-3,3,3-trifluoro-, methyl ester, methyl 2-dibutoxyphosphoryloxy-3,3,3-trifluoropropanoate, METHYL 2-[(DIBUTOXYPHOSPHORYL)OXY]-3,3,3-TRIFLUOROPROPANOATE
| Molecular Formula | C12H22F3O6P |
|---|---|
| Molecular Weight | 350.11 g/mol |
| LogP | 3.8484 |
| Topological Polar Surface Area | 71.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 350.1106 |
| Heavy Atoms | 22 |
| Complexity | 360.3633 |
Chemical Identifiers
| CAS Number | 108682-53-7 |
|---|---|
| SMILES | CCCCOP(=O)(OCCCC)OC(C(=O)OC)C(F)(F)F |
Product Overview
Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate (CAS 108682-53-7), with molecular formula C12H22F3O6P and molecular weight 350.11 g/mol. IUPAC: methyl 2-dibutoxyphosphoryloxy-3,3,3-trifluoropropanoate.
Chemical Property Profile of Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate
Property Insights of Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate
The XLogP value of 3.8484 indicates that Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate. Following Lipinski's Rule of Five, Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate has 0 hydrogen bond donor(s) and 6 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 Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate?
The CAS number of Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate is 108682-53-7.
What is the molecular formula of Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate?
The molecular formula of Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate is C12H22F3O6P.
What is the molecular weight of Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate?
The molecular weight of Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate is 350.11 g/mol.
Where can I buy Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate?
You can request a quote for Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for Lactic acid, 3,3,3-trifluoro-, methyl ester, dibutyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.