2-Nitrophenyl stearate
TL;DR: 2-Nitrophenyl stearate (CAS 104809-27-0) is a chemical compound with molecular formula C24H39NO4 and molecular weight 405.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-nitrophenyl) octadecanoate
Also Known As: 2-Nitrophenyl stearate, O-Nitrophenyl stearate, (2-nitrophenyl) Octadecanoate, nitrophenyl stearate, 2-nitrophenyl octadecanoate
| Molecular Formula | C24H39NO4 |
|---|---|
| Molecular Weight | 405.29 g/mol |
| LogP | 7.7617 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 18 |
| Exact Mass | 405.2879 |
| Heavy Atoms | 29 |
| Complexity | 573.754 |
Chemical Identifiers
| CAS Number | 104809-27-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OC1=CC=CC=C1[N+](=O)[O-] |
Product Overview
2-Nitrophenyl stearate (CAS 104809-27-0), with molecular formula C24H39NO4 and molecular weight 405.29 g/mol. IUPAC: (2-nitrophenyl) octadecanoate.
Chemical Property Profile of 2-Nitrophenyl stearate
Property Insights of 2-Nitrophenyl stearate
The XLogP value of 7.7617 indicates that 2-Nitrophenyl stearate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Nitrophenyl stearate. Following Lipinski's Rule of Five, 2-Nitrophenyl stearate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Nitrophenyl stearate?
The CAS number of 2-Nitrophenyl stearate is 104809-27-0.
What is the molecular formula of 2-Nitrophenyl stearate?
The molecular formula of 2-Nitrophenyl stearate is C24H39NO4.
What is the molecular weight of 2-Nitrophenyl stearate?
The molecular weight of 2-Nitrophenyl stearate is 405.29 g/mol.
Where can I buy 2-Nitrophenyl stearate?
You can request a quote for 2-Nitrophenyl stearate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Nitrophenyl stearate?
Yes, KEHONG BIO provides custom synthesis services for 2-Nitrophenyl stearate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.