1-(Hexadecyloxy)-3-nitrobenzene
TL;DR: 1-(Hexadecyloxy)-3-nitrobenzene (CAS 1806-72-0) is a chemical compound with molecular formula C22H37NO3 and molecular weight 363.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hexadecoxy-3-nitrobenzene
Also Known As: 1-(hexadecyloxy)-3-nitrobenzene, 1-hexadecoxy-3-nitrobenzene, 1-(3-nitrophenoxy)hexadecane, n-Hexadecyl-m-nitrophenyl-ether, 1-Hexadecyloxy-3-nitro-benzene
| Molecular Formula | C22H37NO3 |
|---|---|
| Molecular Weight | 363.28 g/mol |
| LogP | 7.4549 |
| Topological Polar Surface Area | 52.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 17 |
| Exact Mass | 363.27734 |
| Heavy Atoms | 26 |
| Complexity | 476.21008 |
Chemical Identifiers
| CAS Number | 1806-72-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCOC1=CC=CC(=C1)[N+](=O)[O-] |
Product Overview
1-(Hexadecyloxy)-3-nitrobenzene (CAS 1806-72-0), with molecular formula C22H37NO3 and molecular weight 363.28 g/mol. IUPAC: 1-hexadecoxy-3-nitrobenzene.
Chemical Property Profile of 1-(Hexadecyloxy)-3-nitrobenzene
Property Insights of 1-(Hexadecyloxy)-3-nitrobenzene
The XLogP value of 7.4549 indicates that 1-(Hexadecyloxy)-3-nitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.37 Ų, 1-(Hexadecyloxy)-3-nitrobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Hexadecyloxy)-3-nitrobenzene 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 1-(Hexadecyloxy)-3-nitrobenzene?
The CAS number of 1-(Hexadecyloxy)-3-nitrobenzene is 1806-72-0.
What is the molecular formula of 1-(Hexadecyloxy)-3-nitrobenzene?
The molecular formula of 1-(Hexadecyloxy)-3-nitrobenzene is C22H37NO3.
What is the molecular weight of 1-(Hexadecyloxy)-3-nitrobenzene?
The molecular weight of 1-(Hexadecyloxy)-3-nitrobenzene is 363.28 g/mol.
Where can I buy 1-(Hexadecyloxy)-3-nitrobenzene?
You can request a quote for 1-(Hexadecyloxy)-3-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Hexadecyloxy)-3-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(Hexadecyloxy)-3-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.