Aniline, p-(3-phenylpropoxy)-
TL;DR: Aniline, p-(3-phenylpropoxy)- (CAS 57181-86-9) 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.
4-(3-phenylpropoxy)aniline
Also Known As: 4-(3-phenylpropoxy)aniline, 4-(3-phenylpropoxy)phenylamine, p-(3-Phenylpropoxy)aniline, ANILINE, p-(3-PHENYLPROPOXY)-, 4- PHENYLAMINE
| 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 | 193.0 |
Chemical Identifiers
| CAS Number | 57181-86-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCCOC2=CC=C(C=C2)N |
| InChIKey | TWHJRINTKADTKB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Aniline, p-(3-phenylpropoxy)- (CAS 57181-86-9), with molecular formula C15H17NO and molecular weight 227.13 g/mol. IUPAC: 4-(3-phenylpropoxy)aniline.
Chemical Property Profile of Aniline, p-(3-phenylpropoxy)-
Property Insights of Aniline, p-(3-phenylpropoxy)-
The XLogP value of 3.5 indicates that Aniline, p-(3-phenylpropoxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.3 Ų, Aniline, p-(3-phenylpropoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aniline, p-(3-phenylpropoxy)- 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 Aniline, p-(3-phenylpropoxy)-?
The CAS number of Aniline, p-(3-phenylpropoxy)- is 57181-86-9.
What is the molecular formula of Aniline, p-(3-phenylpropoxy)-?
The molecular formula of Aniline, p-(3-phenylpropoxy)- is C15H17NO.
What is the molecular weight of Aniline, p-(3-phenylpropoxy)-?
The molecular weight of Aniline, p-(3-phenylpropoxy)- is 227.13 g/mol.
Where can I buy Aniline, p-(3-phenylpropoxy)-?
You can request a quote for Aniline, p-(3-phenylpropoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aniline, p-(3-phenylpropoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Aniline, p-(3-phenylpropoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.