5-Chloro-2,4-dimethoxyaniline
TL;DR: 5-Chloro-2,4-dimethoxyaniline (CAS 97-50-7) is a chemical compound with molecular formula C8H10ClNO2 and molecular weight 187.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2,4-dimethoxyaniline
Also Known As: 5-Chloro-2,4-dimethoxyaniline, ITR Amine, oxoaluminum, Benzenamine, 5-chloro-2,4-dimethoxy-, 2,4-dimethoxy-5-chloroaniline
| Molecular Formula | C8H10ClNO2 |
|---|---|
| Molecular Weight | 187.04 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 44.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.04001 |
| Heavy Atoms | 12 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 97-50-7 |
|---|---|
| SMILES | COC1=CC(=C(C=C1N)Cl)OC |
| InChIKey | OLCMNCWEUMBNIS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Chloro-2,4-dimethoxyaniline (CAS 97-50-7), with molecular formula C8H10ClNO2 and molecular weight 187.04 g/mol. IUPAC: 5-chloro-2,4-dimethoxyaniline.
Chemical Property Profile of 5-Chloro-2,4-dimethoxyaniline
Property Insights of 5-Chloro-2,4-dimethoxyaniline
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-2,4-dimethoxyaniline. With a topological polar surface area (TPSA) of 44.5 Ų, 5-Chloro-2,4-dimethoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-2,4-dimethoxyaniline 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
Frequently Asked Questions
What is the CAS number of 5-Chloro-2,4-dimethoxyaniline?
The CAS number of 5-Chloro-2,4-dimethoxyaniline is 97-50-7.
What is the molecular formula of 5-Chloro-2,4-dimethoxyaniline?
The molecular formula of 5-Chloro-2,4-dimethoxyaniline is C8H10ClNO2.
What is the molecular weight of 5-Chloro-2,4-dimethoxyaniline?
The molecular weight of 5-Chloro-2,4-dimethoxyaniline is 187.04 g/mol.
Where can I buy 5-Chloro-2,4-dimethoxyaniline?
You can request a quote for 5-Chloro-2,4-dimethoxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-2,4-dimethoxyaniline?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-2,4-dimethoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.