![N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline structure](/static/products/159/159110-58-4.webp)
N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline
TL;DR: N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline (CAS 159110-58-4) is a chemical compound with molecular formula C18H21NO2 and molecular weight 283.15723 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline
Also Known As: N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline, N-(1-(3,4-dimethoxyphenyl)but-3-en-1-yl)aniline, [1-(3,4-Dimethoxy-phenyl)-but-3-enyl]-phenyl-amine, 1-(3,4-dimethoxyphenyl)but-3-enyl-phenyl-amine
Technical Specifications
| Molecular Formula | C18H21NO2 |
| Molecular Weight | 283.15723 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 30.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 283.15723 Da |
| Heavy Atoms | 21 |
| Complexity | 302.0 |
| SMILES | COC1=C(C=C(C=C1)C(CC=C)NC2=CC=CC=C2)OC |
| InChIKey | XQAOERIZYMRWSJ-UHFFFAOYSA-N |
Chemical Property Profile of N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline
Property Insights of N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline
The XLogP value of 4.5 indicates that N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.5 Ų, N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline?
The CAS number of N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline is 159110-58-4.
What is the molecular formula of N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline?
The molecular formula of N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline is C18H21NO2.
What is the molecular weight of N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline?
The molecular weight of N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline is 283.15723 g/mol.
Where can I buy N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline?
You can request a quote for N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline?
Yes, CoreyChem provides custom synthesis services for N-[1-(3,4-dimethoxyphenyl)but-3-enyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.