2,2-Dimethylpropanoyloxymethyl pentanoate
TL;DR: 2,2-Dimethylpropanoyloxymethyl pentanoate (CAS 137373-54-7) is a chemical compound with molecular formula C11H20O4 and molecular weight 216.13615 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2-dimethylpropanoyloxymethyl pentanoate
Also Known As: Pentanoic acid pivaloyloxymethyl ester, Pentanoyloxymethyl 2,2-dimethylpropanoate, Pentanoic acid, (2,2-dimethyl-1-oxopropoxy)methyl ester, [(2,2-DIMETHYLPROPANOYL)OXY]METHYL PENTANOATE
Technical Specifications
| Molecular Formula | C11H20O4 |
| Molecular Weight | 216.13615 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 216.13615 Da |
| Heavy Atoms | 15 |
| Complexity | 215.0 |
| SMILES | CCCCC(=O)OCOC(=O)C(C)(C)C |
| InChIKey | CETYKLVKISPLFQ-UHFFFAOYSA-N |
Chemical Property Profile of 2,2-Dimethylpropanoyloxymethyl pentanoate
Property Insights of 2,2-Dimethylpropanoyloxymethyl pentanoate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Dimethylpropanoyloxymethyl pentanoate. With a topological polar surface area (TPSA) of 52.6 Ų, 2,2-Dimethylpropanoyloxymethyl pentanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Dimethylpropanoyloxymethyl pentanoate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,2-Dimethylpropanoyloxymethyl pentanoate?
The CAS number of 2,2-Dimethylpropanoyloxymethyl pentanoate is 137373-54-7.
What is the molecular formula of 2,2-Dimethylpropanoyloxymethyl pentanoate?
The molecular formula of 2,2-Dimethylpropanoyloxymethyl pentanoate is C11H20O4.
What is the molecular weight of 2,2-Dimethylpropanoyloxymethyl pentanoate?
The molecular weight of 2,2-Dimethylpropanoyloxymethyl pentanoate is 216.13615 g/mol.
Where can I buy 2,2-Dimethylpropanoyloxymethyl pentanoate?
You can request a quote for 2,2-Dimethylpropanoyloxymethyl pentanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,2-Dimethylpropanoyloxymethyl pentanoate?
Yes, CoreyChem provides custom synthesis services for 2,2-Dimethylpropanoyloxymethyl pentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.