2,2,4-Trimethylpentyl laurate
TL;DR: 2,2,4-Trimethylpentyl laurate (CAS 71672-90-7) is a chemical compound with molecular formula C20H40O2 and molecular weight 312.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,4-trimethylpentyl dodecanoate
Also Known As: 2,2,4-Trimethylpentyl laurate, 2,2,4-trimethylpentyl dodecanoate, 2,2,4-trimethylpentyllaurate, EINECS 275-825-4, Dodecanoic acid 2,2,4-trimethylpentyl ester
| Molecular Formula | C20H40O2 |
|---|---|
| Molecular Weight | 312.30 g/mol |
| LogP | 6.5228 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Exact Mass | 312.30283 |
| Heavy Atoms | 22 |
| Complexity | 268.8808 |
Chemical Identifiers
| CAS Number | 71672-90-7 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)OCC(C)(C)CC(C)C |
Product Overview
2,2,4-Trimethylpentyl laurate (CAS 71672-90-7), with molecular formula C20H40O2 and molecular weight 312.30 g/mol. IUPAC: 2,2,4-trimethylpentyl dodecanoate.
Chemical Property Profile of 2,2,4-Trimethylpentyl laurate
Property Insights of 2,2,4-Trimethylpentyl laurate
The XLogP value of 6.5228 indicates that 2,2,4-Trimethylpentyl laurate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2,2,4-Trimethylpentyl laurate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,4-Trimethylpentyl laurate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,2,4-Trimethylpentyl laurate?
The CAS number of 2,2,4-Trimethylpentyl laurate is 71672-90-7.
What is the molecular formula of 2,2,4-Trimethylpentyl laurate?
The molecular formula of 2,2,4-Trimethylpentyl laurate is C20H40O2.
What is the molecular weight of 2,2,4-Trimethylpentyl laurate?
The molecular weight of 2,2,4-Trimethylpentyl laurate is 312.30 g/mol.
Where can I buy 2,2,4-Trimethylpentyl laurate?
You can request a quote for 2,2,4-Trimethylpentyl laurate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,4-Trimethylpentyl laurate?
Yes, KEHONG BIO provides custom synthesis services for 2,2,4-Trimethylpentyl laurate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.