3-(3-Phenylpropoxy)aniline
TL;DR: 3-(3-Phenylpropoxy)aniline (CAS 17823-87-9) is a chemical compound with molecular formula C15H17NO and molecular weight 227.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-phenylpropoxy)aniline
Also Known As: 3-(3-phenylpropoxy)aniline, 3-(3-phenylpropoxy)phenylamine, 2,2-bismercaptomethyl-1-cyanoacrylamide, 3-(3-PHENYLPROPOXY)ANILINE 95%, Y-2567
| Molecular Formula | C15H17NO |
|---|---|
| Molecular Weight | 227.13 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 227.13101 |
| Heavy Atoms | 17 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 17823-87-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCCOC2=CC=CC(=C2)N |
| InChIKey | NOHOYGXEORYNFY-UHFFFAOYSA-N |
Product Overview
3-(3-Phenylpropoxy)aniline (CAS 17823-87-9), with molecular formula C15H17NO and molecular weight 227.13 g/mol. IUPAC: 3-(3-phenylpropoxy)aniline.
Chemical Property Profile of 3-(3-Phenylpropoxy)aniline
Property Insights of 3-(3-Phenylpropoxy)aniline
The XLogP value of 3.5 indicates that 3-(3-Phenylpropoxy)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.3 Ų, 3-(3-Phenylpropoxy)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Phenylpropoxy)aniline has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(3-Phenylpropoxy)aniline?
The CAS number of 3-(3-Phenylpropoxy)aniline is 17823-87-9.
What is the molecular formula of 3-(3-Phenylpropoxy)aniline?
The molecular formula of 3-(3-Phenylpropoxy)aniline is C15H17NO.
What is the molecular weight of 3-(3-Phenylpropoxy)aniline?
The molecular weight of 3-(3-Phenylpropoxy)aniline is 227.13 g/mol.
Where can I buy 3-(3-Phenylpropoxy)aniline?
You can request a quote for 3-(3-Phenylpropoxy)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Phenylpropoxy)aniline?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Phenylpropoxy)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.