N-but-2-enyl-4-methylaniline
TL;DR: N-but-2-enyl-4-methylaniline (CAS 4043-69-0) is a chemical compound with molecular formula C11H15N and molecular weight 161.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-but-2-enyl-4-methylaniline
Also Known As: N-CROTYL-p-TOLUIDINE, N-but-2-enyl-4-methylaniline, N-[(E)-but-2-enyl]-4-methylaniline
| Molecular Formula | C11H15N |
|---|---|
| Molecular Weight | 161.12 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 161.12045 |
| Heavy Atoms | 12 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 4043-69-0 |
|---|---|
| SMILES | CC=CCNC1=CC=C(C=C1)C |
| InChIKey | JHEPPYHYYIYFQJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-but-2-enyl-4-methylaniline (CAS 4043-69-0), with molecular formula C11H15N and molecular weight 161.12 g/mol. IUPAC: N-but-2-enyl-4-methylaniline.
Chemical Property Profile of N-but-2-enyl-4-methylaniline
Property Insights of N-but-2-enyl-4-methylaniline
The XLogP value of 3.1 indicates that N-but-2-enyl-4-methylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, N-but-2-enyl-4-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-but-2-enyl-4-methylaniline 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 N-but-2-enyl-4-methylaniline?
The CAS number of N-but-2-enyl-4-methylaniline is 4043-69-0.
What is the molecular formula of N-but-2-enyl-4-methylaniline?
The molecular formula of N-but-2-enyl-4-methylaniline is C11H15N.
What is the molecular weight of N-but-2-enyl-4-methylaniline?
The molecular weight of N-but-2-enyl-4-methylaniline is 161.12 g/mol.
Where can I buy N-but-2-enyl-4-methylaniline?
You can request a quote for N-but-2-enyl-4-methylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-but-2-enyl-4-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-but-2-enyl-4-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.