2,2-Bis(hydroxymethyl)butyl decanoate
TL;DR: 2,2-Bis(hydroxymethyl)butyl decanoate (CAS 64131-19-7) is a chemical compound with molecular formula C16H32O4 and molecular weight 288.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-bis(hydroxymethyl)butyl decanoate
Also Known As: 2,2-bis butyldecanoate, 2,2-Bis(hydroxymethyl)butyl decanoate, Trimethylolpropane caprate, EINECS 264-687-0, trimethylolpropane decanoate
| Molecular Formula | C16H32O4 |
|---|---|
| Molecular Weight | 288.23 g/mol |
| LogP | 3.0513 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 288.23007 |
| Heavy Atoms | 20 |
| Complexity | 228.36671 |
Chemical Identifiers
| CAS Number | 64131-19-7 |
|---|---|
| SMILES | CCCCCCCCCC(=O)OCC(CC)(CO)CO |
Product Overview
2,2-Bis(hydroxymethyl)butyl decanoate (CAS 64131-19-7), with molecular formula C16H32O4 and molecular weight 288.23 g/mol. IUPAC: 2,2-bis(hydroxymethyl)butyl decanoate.
Chemical Property Profile of 2,2-Bis(hydroxymethyl)butyl decanoate
Property Insights of 2,2-Bis(hydroxymethyl)butyl decanoate
The XLogP value of 3.0513 indicates that 2,2-Bis(hydroxymethyl)butyl decanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-Bis(hydroxymethyl)butyl decanoate. Following Lipinski's Rule of Five, 2,2-Bis(hydroxymethyl)butyl decanoate has 2 hydrogen bond donor(s) and 4 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 2,2-Bis(hydroxymethyl)butyl decanoate?
The CAS number of 2,2-Bis(hydroxymethyl)butyl decanoate is 64131-19-7.
What is the molecular formula of 2,2-Bis(hydroxymethyl)butyl decanoate?
The molecular formula of 2,2-Bis(hydroxymethyl)butyl decanoate is C16H32O4.
What is the molecular weight of 2,2-Bis(hydroxymethyl)butyl decanoate?
The molecular weight of 2,2-Bis(hydroxymethyl)butyl decanoate is 288.23 g/mol.
Where can I buy 2,2-Bis(hydroxymethyl)butyl decanoate?
You can request a quote for 2,2-Bis(hydroxymethyl)butyl decanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Bis(hydroxymethyl)butyl decanoate?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Bis(hydroxymethyl)butyl decanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.