N-(3-Chlorobenzyl)-2,3-dimethylaniline
TL;DR: N-(3-Chlorobenzyl)-2,3-dimethylaniline (CAS 1024246-91-0) is a chemical compound with molecular formula C15H16ClN and molecular weight 245.09712 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(3-chlorophenyl)methyl]-2,3-dimethylaniline
Also Known As: N-(3-CHLOROBENZYL)-2,3-DIMETHYLANILINE, N-[(3-chlorophenyl)methyl]-2,3-dimethylaniline, N-[(3-chlorophenyl)methyl]-2,3-dimethyl-aniline, Benzenemethanamine, 3-chloro-N-(2,3-dimethylphenyl)-
Technical Specifications
| Molecular Formula | C15H16ClN |
| Molecular Weight | 245.09712 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.09712 Da |
| Heavy Atoms | 17 |
| Complexity | 231.0 |
| SMILES | CC1=C(C(=CC=C1)NCC2=CC(=CC=C2)Cl)C |
| InChIKey | MDTHIPUFQRDMCJ-UHFFFAOYSA-N |
Chemical Property Profile of N-(3-Chlorobenzyl)-2,3-dimethylaniline
Property Insights of N-(3-Chlorobenzyl)-2,3-dimethylaniline
The XLogP value of 4.8 indicates that N-(3-Chlorobenzyl)-2,3-dimethylaniline 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-(3-Chlorobenzyl)-2,3-dimethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-Chlorobenzyl)-2,3-dimethylaniline 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
What is the CAS number of N-(3-Chlorobenzyl)-2,3-dimethylaniline?
The CAS number of N-(3-Chlorobenzyl)-2,3-dimethylaniline is 1024246-91-0.
What is the molecular formula of N-(3-Chlorobenzyl)-2,3-dimethylaniline?
The molecular formula of N-(3-Chlorobenzyl)-2,3-dimethylaniline is C15H16ClN.
What is the molecular weight of N-(3-Chlorobenzyl)-2,3-dimethylaniline?
The molecular weight of N-(3-Chlorobenzyl)-2,3-dimethylaniline is 245.09712 g/mol.
Where can I buy N-(3-Chlorobenzyl)-2,3-dimethylaniline?
You can request a quote for N-(3-Chlorobenzyl)-2,3-dimethylaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(3-Chlorobenzyl)-2,3-dimethylaniline?
Yes, CoreyChem provides custom synthesis services for N-(3-Chlorobenzyl)-2,3-dimethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.