RefChem:71616
TL;DR: RefChem:71616 (CAS 68443-43-6) is a chemical compound with molecular formula C46H66O10 and molecular weight 778.4656 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-O-[2-[(2-decoxycarbonylbenzoyl)oxymethyl]-2-(2-methylprop-2-enoyloxymethyl)butyl] 1-O-decyl benzene-1,2-dicarboxylate
Also Known As: 1,2-Benzenedicarboxylic acid, 2-ethyl-2-[[(2-methyl-1-oxo-2-propenyl)oxy]methyl]-1,3-propanediyl didecyl ester, didecyl2-ethyl-2-[[oxy]methyl]propane-1,3-diylphthalate, 1,2-Benzenedicarboxylic acid, 1,1'-(2-ethyl-2-(((2-methyl-1-oxo-2-propen-1-yl)oxy)methyl)-1,3-propanediyl) 2,2'-didecyl ester, 1,2-Benzenedicarboxylic acid, 2-ethyl-2-(((2-methyl-1-oxo-2-propenyl)oxy)methyl)-1,3-propanediyl didecyl ester, Didecyl 2-ethyl-2-(((2-methyl-1-oxoallyl)oxy)methyl)propane-1,3-diylphthalate
Technical Specifications
| Molecular Formula | C46H66O10 |
| Molecular Weight | 778.4656 g/mol |
| XLogP | 13.9 |
| Topological Polar Surface Area (TPSA) | 132.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 35 |
| Exact Mass | 778.4656 Da |
| Heavy Atoms | 56 |
| Complexity | 1090.0 |
| SMILES | CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCC(CC)(COC(=O)C2=CC=CC=C2C(=O)OCCCCCCCCCC)COC(=O)C(=C)C |
| InChIKey | XLWCDUFQDYZSAZ-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:71616
Property Insights of RefChem:71616
The XLogP value of 13.9 indicates that RefChem:71616 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:71616. Following Lipinski's Rule of Five, RefChem:71616 has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:71616?
The CAS number of RefChem:71616 is 68443-43-6.
What is the molecular formula of RefChem:71616?
The molecular formula of RefChem:71616 is C46H66O10.
What is the molecular weight of RefChem:71616?
The molecular weight of RefChem:71616 is 778.4656 g/mol.
Where can I buy RefChem:71616?
You can request a quote for RefChem:71616 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:71616?
Yes, CoreyChem provides custom synthesis services for RefChem:71616 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.