Octadecyl nicotinate
TL;DR: Octadecyl nicotinate (CAS 6623-07-0) is a chemical compound with molecular formula C24H41NO2 and molecular weight 375.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octadecyl pyridine-3-carboxylate
Also Known As: Octadecyl nicotinate, Nicotinic acid, octadecyl ester, octadecyl pyridine-3-carboxylate, Nicotinsaeuremethylester-5-(oxo-3-butyl), RefChem:366734
| Molecular Formula | C24H41NO2 |
|---|---|
| Molecular Weight | 375.31 g/mol |
| LogP | 10.1 |
| Topological Polar Surface Area | 39.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 19 |
| Exact Mass | 375.31372 |
| Heavy Atoms | 27 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 6623-07-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCOC(=O)C1=CN=CC=C1 |
| InChIKey | LCMBGJRROPDVAA-UHFFFAOYSA-N |
Product Overview
Octadecyl nicotinate (CAS 6623-07-0), with molecular formula C24H41NO2 and molecular weight 375.31 g/mol. IUPAC: octadecyl pyridine-3-carboxylate.
Chemical Property Profile of Octadecyl nicotinate
Property Insights of Octadecyl nicotinate
The XLogP value of 10.1 indicates that Octadecyl nicotinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.2 Ų, Octadecyl nicotinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octadecyl nicotinate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Octadecyl nicotinate?
The CAS number of Octadecyl nicotinate is 6623-07-0.
What is the molecular formula of Octadecyl nicotinate?
The molecular formula of Octadecyl nicotinate is C24H41NO2.
What is the molecular weight of Octadecyl nicotinate?
The molecular weight of Octadecyl nicotinate is 375.31 g/mol.
Where can I buy Octadecyl nicotinate?
You can request a quote for Octadecyl nicotinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octadecyl nicotinate?
Yes, KEHONG BIO provides custom synthesis services for Octadecyl nicotinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.