p-Decyloxyaniline
TL;DR: p-Decyloxyaniline (CAS 39905-47-0) is a chemical compound with molecular formula C16H27NO and molecular weight 249.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-decoxyaniline
Also Known As: p-Decyloxyaniline, 4-decoxyaniline, 4-n-Decyloxyaniline, 4-(Decyloxy)aniline, 4-Decyloxyaniline
| Molecular Formula | C16H27NO |
|---|---|
| Molecular Weight | 249.21 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 249.20926 |
| Heavy Atoms | 18 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 39905-47-0 |
|---|---|
| SMILES | CCCCCCCCCCOC1=CC=C(C=C1)N |
| InChIKey | XWGJQNKDSHYJID-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
p-Decyloxyaniline (CAS 39905-47-0), with molecular formula C16H27NO and molecular weight 249.21 g/mol. IUPAC: 4-decoxyaniline.
Chemical Property Profile of p-Decyloxyaniline
Property Insights of p-Decyloxyaniline
The XLogP value of 5.9 indicates that p-Decyloxyaniline 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-Decyloxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Decyloxyaniline 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-Decyloxyaniline?
The CAS number of p-Decyloxyaniline is 39905-47-0.
What is the molecular formula of p-Decyloxyaniline?
The molecular formula of p-Decyloxyaniline is C16H27NO.
What is the molecular weight of p-Decyloxyaniline?
The molecular weight of p-Decyloxyaniline is 249.21 g/mol.
Where can I buy p-Decyloxyaniline?
You can request a quote for p-Decyloxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Decyloxyaniline?
Yes, KEHONG BIO provides custom synthesis services for p-Decyloxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.