3,4-Dimethoxyaniline hydrochloride
TL;DR: 3,4-Dimethoxyaniline hydrochloride (CAS 35589-32-3) is a chemical compound with molecular formula C8H12ClNO2 and molecular weight 189.05565 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,4-dimethoxyaniline;hydrochloride
Also Known As: 3,4-dimethoxyaniline hydrochloride, 3,4-Dimethoxyanilinium chloride, 3,4-dimethoxyaniline;hydrochloride, 3,4-Dimethoxyaniline HCl, 3,4-dimethoxyaniline,hydrochloride
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H12ClNO2 |
| Molecular Weight | 189.05565 g/mol |
| XLogP | 1.71 |
| Topological Polar Surface Area (TPSA) | 44.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.05565 Da |
| Heavy Atoms | 12 |
| Complexity | 119.0 |
| SMILES | COC1=C(C=C(C=C1)N)OC.Cl |
| InChIKey | ONQXLLAHSKZOMV-UHFFFAOYSA-N |
Chemical Property Profile of 3,4-Dimethoxyaniline hydrochloride
Property Insights of 3,4-Dimethoxyaniline hydrochloride
The XLogP value of 1.71 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dimethoxyaniline hydrochloride. With a topological polar surface area (TPSA) of 44.5 Ų, 3,4-Dimethoxyaniline hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dimethoxyaniline hydrochloride has 2 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 3,4-Dimethoxyaniline hydrochloride?
The CAS number of 3,4-Dimethoxyaniline hydrochloride is 35589-32-3.
What is the molecular formula of 3,4-Dimethoxyaniline hydrochloride?
The molecular formula of 3,4-Dimethoxyaniline hydrochloride is C8H12ClNO2.
What is the molecular weight of 3,4-Dimethoxyaniline hydrochloride?
The molecular weight of 3,4-Dimethoxyaniline hydrochloride is 189.05565 g/mol.
Where can I buy 3,4-Dimethoxyaniline hydrochloride?
You can request a quote for 3,4-Dimethoxyaniline hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,4-Dimethoxyaniline hydrochloride?
Yes, CoreyChem provides custom synthesis services for 3,4-Dimethoxyaniline hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.