N-Cinnamyl-4-methoxyaniline
TL;DR: N-Cinnamyl-4-methoxyaniline (CAS 22774-93-2) is a chemical compound with molecular formula C16H17NO and molecular weight 239.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-N-[(E)-3-phenylprop-2-enyl]aniline
Also Known As: N-Cinnamyl-4-methoxyaniline, N-trans-Cinnamyl-4-methoxyaniline, N-(3-Phenylallyl)-4-methoxyaniline, N-(3-Phenylallyl)-p-methoxyaniline, N-(4-Methoxyphenyl)-trans-cinnamylamine
| Molecular Formula | C16H17NO |
|---|---|
| Molecular Weight | 239.13 g/mol |
| LogP | 3.8205 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 239.13101 |
| Heavy Atoms | 18 |
| Complexity | 488.26523 |
Chemical Identifiers
| CAS Number | 22774-93-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC/C=C/C2=CC=CC=C2 |
Product Overview
N-Cinnamyl-4-methoxyaniline (CAS 22774-93-2), with molecular formula C16H17NO and molecular weight 239.13 g/mol. IUPAC: 4-methoxy-N-[(E)-3-phenylprop-2-enyl]aniline.
Chemical Property Profile of N-Cinnamyl-4-methoxyaniline
Property Insights of N-Cinnamyl-4-methoxyaniline
The XLogP value of 3.8205 indicates that N-Cinnamyl-4-methoxyaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.26 Ų, N-Cinnamyl-4-methoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Cinnamyl-4-methoxyaniline 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 N-Cinnamyl-4-methoxyaniline?
The CAS number of N-Cinnamyl-4-methoxyaniline is 22774-93-2.
What is the molecular formula of N-Cinnamyl-4-methoxyaniline?
The molecular formula of N-Cinnamyl-4-methoxyaniline is C16H17NO.
What is the molecular weight of N-Cinnamyl-4-methoxyaniline?
The molecular weight of N-Cinnamyl-4-methoxyaniline is 239.13 g/mol.
Where can I buy N-Cinnamyl-4-methoxyaniline?
You can request a quote for N-Cinnamyl-4-methoxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Cinnamyl-4-methoxyaniline?
Yes, KEHONG BIO provides custom synthesis services for N-Cinnamyl-4-methoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.