Aniline, m-phenethyl-
TL;DR: Aniline, m-phenethyl- (CAS 5369-22-2) is a chemical compound with molecular formula C14H15N and molecular weight 197.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-phenylethyl)aniline
Also Known As: Aniline, m-phenethyl-, 3-phenethylaniline, m-Phenethylaniline, 3-(2-Phenylethyl)aniline, Benzenamine, 3-(2-phenylethyl)-
| Molecular Formula | C14H15N |
|---|---|
| Molecular Weight | 197.12 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 197.12045 |
| Heavy Atoms | 15 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 5369-22-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCC2=CC(=CC=C2)N |
| InChIKey | VJPPMUFNJJMKGK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Aniline, m-phenethyl- (CAS 5369-22-2), with molecular formula C14H15N and molecular weight 197.12 g/mol. IUPAC: 3-(2-phenylethyl)aniline.
Chemical Property Profile of Aniline, m-phenethyl-
Property Insights of Aniline, m-phenethyl-
The XLogP value of 3.5 indicates that Aniline, m-phenethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, Aniline, m-phenethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aniline, m-phenethyl- has 1 hydrogen bond donor(s) and 1 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, m-phenethyl-?
The CAS number of Aniline, m-phenethyl- is 5369-22-2.
What is the molecular formula of Aniline, m-phenethyl-?
The molecular formula of Aniline, m-phenethyl- is C14H15N.
What is the molecular weight of Aniline, m-phenethyl-?
The molecular weight of Aniline, m-phenethyl- is 197.12 g/mol.
Where can I buy Aniline, m-phenethyl-?
You can request a quote for Aniline, m-phenethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aniline, m-phenethyl-?
Yes, KEHONG BIO provides custom synthesis services for Aniline, m-phenethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.