N-Methyl-N-(2-methylallyl)aniline
TL;DR: N-Methyl-N-(2-methylallyl)aniline (CAS 6045-18-7) 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-methyl-N-(2-methylprop-2-enyl)aniline
Also Known As: N-methyl-2-methylallylaniline, N-Methyl-N-(2-methylallyl)aniline, Methylphenyl(2-methylallyl)amine, N-(2-methyl-2-propenyl)-N-methylaniline, N-(2-Methylallyl)-N-methylaniline
| Molecular Formula | C11H15N |
|---|---|
| Molecular Weight | 161.12 g/mol |
| LogP | 2.6989 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 161.12045 |
| Heavy Atoms | 12 |
| Complexity | 250.96645 |
Chemical Identifiers
| CAS Number | 6045-18-7 |
|---|---|
| SMILES | CC(=C)CN(C)C1=CC=CC=C1 |
Product Overview
N-Methyl-N-(2-methylallyl)aniline (CAS 6045-18-7), with molecular formula C11H15N and molecular weight 161.12 g/mol. IUPAC: N-methyl-N-(2-methylprop-2-enyl)aniline.
Chemical Property Profile of N-Methyl-N-(2-methylallyl)aniline
Property Insights of N-Methyl-N-(2-methylallyl)aniline
The XLogP value of 2.6989 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methyl-N-(2-methylallyl)aniline. With a topological polar surface area (TPSA) of 3.24 Ų, N-Methyl-N-(2-methylallyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Methyl-N-(2-methylallyl)aniline has 0 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-Methyl-N-(2-methylallyl)aniline?
The CAS number of N-Methyl-N-(2-methylallyl)aniline is 6045-18-7.
What is the molecular formula of N-Methyl-N-(2-methylallyl)aniline?
The molecular formula of N-Methyl-N-(2-methylallyl)aniline is C11H15N.
What is the molecular weight of N-Methyl-N-(2-methylallyl)aniline?
The molecular weight of N-Methyl-N-(2-methylallyl)aniline is 161.12 g/mol.
Where can I buy N-Methyl-N-(2-methylallyl)aniline?
You can request a quote for N-Methyl-N-(2-methylallyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methyl-N-(2-methylallyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for N-Methyl-N-(2-methylallyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.