p-Hexadecyloxyaniline
TL;DR: p-Hexadecyloxyaniline (CAS 7502-06-9) is a chemical compound with molecular formula C22H39NO and molecular weight 333.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hexadecoxyaniline
Also Known As: p-Hexadecyloxyaniline, 4-n-Hexadecyloxyaniline, 4-(Hexadecyloxy)aniline, 4-hexadecoxyaniline, 4-Hexadecyloxyaniline
| Molecular Formula | C22H39NO |
|---|---|
| Molecular Weight | 333.30 g/mol |
| LogP | 9.1 |
| Topological Polar Surface Area | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 16 |
| Exact Mass | 333.30316 |
| Heavy Atoms | 24 |
| Complexity | 248.0 |
Chemical Identifiers
| CAS Number | 7502-06-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)N |
| InChIKey | DETPMDIIFZGDAE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
p-Hexadecyloxyaniline (CAS 7502-06-9), with molecular formula C22H39NO and molecular weight 333.30 g/mol. IUPAC: 4-hexadecoxyaniline.
Chemical Property Profile of p-Hexadecyloxyaniline
Property Insights of p-Hexadecyloxyaniline
The XLogP value of 9.1 indicates that p-Hexadecyloxyaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.3 Ų, p-Hexadecyloxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Hexadecyloxyaniline has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of p-Hexadecyloxyaniline?
The CAS number of p-Hexadecyloxyaniline is 7502-06-9.
What is the molecular formula of p-Hexadecyloxyaniline?
The molecular formula of p-Hexadecyloxyaniline is C22H39NO.
What is the molecular weight of p-Hexadecyloxyaniline?
The molecular weight of p-Hexadecyloxyaniline is 333.30 g/mol.
Where can I buy p-Hexadecyloxyaniline?
You can request a quote for p-Hexadecyloxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Hexadecyloxyaniline?
Yes, KEHONG BIO provides custom synthesis services for p-Hexadecyloxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.