3-Picolinyl stearate
TL;DR: 3-Picolinyl stearate (CAS 82120-89-6) 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.
pyridin-3-ylmethyl octadecanoate
Also Known As: 3-Picolinyl stearate, 3-Pyridinemethanolstearate, beta-Picolinyl stearate, 3-Pyridinemethanol stearate, Stearic acid picolinyl ester
| Molecular Formula | C24H41NO2 |
|---|---|
| Molecular Weight | 375.31 g/mol |
| LogP | 9.0 |
| 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 | 82120-89-6 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCC1=CN=CC=C1 |
| InChIKey | MSCVPMAJZWQQRO-UHFFFAOYSA-N |
Product Overview
3-Picolinyl stearate (CAS 82120-89-6), with molecular formula C24H41NO2 and molecular weight 375.31 g/mol. IUPAC: pyridin-3-ylmethyl octadecanoate.
Chemical Property Profile of 3-Picolinyl stearate
Property Insights of 3-Picolinyl stearate
The XLogP value of 9.0 indicates that 3-Picolinyl stearate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.2 Ų, 3-Picolinyl stearate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Picolinyl stearate 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 3-Picolinyl stearate?
The CAS number of 3-Picolinyl stearate is 82120-89-6.
What is the molecular formula of 3-Picolinyl stearate?
The molecular formula of 3-Picolinyl stearate is C24H41NO2.
What is the molecular weight of 3-Picolinyl stearate?
The molecular weight of 3-Picolinyl stearate is 375.31 g/mol.
Where can I buy 3-Picolinyl stearate?
You can request a quote for 3-Picolinyl stearate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Picolinyl stearate?
Yes, KEHONG BIO provides custom synthesis services for 3-Picolinyl stearate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.