Tridecyl Neopentanoate
TL;DR: Tridecyl Neopentanoate (CAS 105859-93-6) is a chemical compound with molecular formula C18H36O2 and molecular weight 284.27155 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tridecyl 2,2-dimethylpropanoate
Also Known As: Tridecyl neopentanoate, Crodamol TDNP, Ceraphyl 55, Trivent NP-13, Tridecyl pivalate
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H36O2 |
| Molecular Weight | 284.27155 g/mol |
| XLogP | 7.5 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Exact Mass | 284.27155 Da |
| Heavy Atoms | 20 |
| Complexity | 228.0 |
| SMILES | CCCCCCCCCCCCCOC(=O)C(C)(C)C |
| InChIKey | DHWLRNPWPABRBG-UHFFFAOYSA-N |
Chemical Property Profile of Tridecyl Neopentanoate
Property Insights of Tridecyl Neopentanoate
The XLogP value of 7.5 indicates that Tridecyl Neopentanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Tridecyl Neopentanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tridecyl Neopentanoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Tridecyl Neopentanoate?
The CAS number of Tridecyl Neopentanoate is 105859-93-6.
What is the molecular formula of Tridecyl Neopentanoate?
The molecular formula of Tridecyl Neopentanoate is C18H36O2.
What is the molecular weight of Tridecyl Neopentanoate?
The molecular weight of Tridecyl Neopentanoate is 284.27155 g/mol.
Where can I buy Tridecyl Neopentanoate?
You can request a quote for Tridecyl Neopentanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tridecyl Neopentanoate?
Yes, CoreyChem provides custom synthesis services for Tridecyl Neopentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.