2,4-Dichloroaniline
TL;DR: 2,4-Dichloroaniline (CAS 554-00-7) is a chemical compound with molecular formula C6H5Cl2N and molecular weight 160.9799 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4-dichloroaniline
Also Known As: 2,4-DICHLOROANILINE, 2,4-Dichloranilin, 2,4-Dichlorobenzenamine, o,p-Dichloroaniline, Benzenamine, 2,4-dichloro-
Application Areas
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H5Cl2N |
| Molecular Weight | 160.9799 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 160.9799 Da |
| Heavy Atoms | 9 |
| Complexity | 97.0 |
| Melting Point | 145 to 147 °F (NTP, 1992) |
| Boiling Point | 473 °F at 760 mmHg (NTP, 1992) |
| Density | 1.567 at 68 °F (NTP, 1992) - Denser than water; will sink |
| Flash Point | 115 °C |
| Vapor Pressure | Vapor pressure, Pa at 25 °C: |
| Solubility | less than 1 mg/mL at 73 °F (NTP, 1992) |
| SMILES | C1=CC(=C(C=C1Cl)Cl)N |
| InChIKey | KQCMTOWTPBNWDB-UHFFFAOYSA-N |
Product Description
Applications: 2,4-Dichloroaniline is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2,4-Dichloroaniline (CAS 554-00-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A heterocyclic building block supplied by CoreyChem, 2,4-Dichloroaniline (CAS 554-00-7) has the molecular formula C6H5Cl2N and a molecular weight of 160.98 g/mol. Reported properties include a density of 1.567 at 68 °F (NTP, 1992) - Denser than water; will sink g/cm³, a solubility: less than 1 mg/mL at 73 °F (NTP, 1992). It is also known as 2,4-DICHLOROANILINE and 2,4-Dichloranilin.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2,4-Dichloroaniline
Property Insights of 2,4-Dichloroaniline
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dichloroaniline. With a topological polar surface area (TPSA) of 26.0 Ų, 2,4-Dichloroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dichloroaniline 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 2,4-Dichloroaniline?
The CAS number of 2,4-Dichloroaniline is 554-00-7.
What is the molecular formula of 2,4-Dichloroaniline?
The molecular formula of 2,4-Dichloroaniline is C6H5Cl2N.
What is the molecular weight of 2,4-Dichloroaniline?
The molecular weight of 2,4-Dichloroaniline is 160.9799 g/mol.
What are the applications of 2,4-Dichloroaniline?
2,4-Dichloroaniline is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2,4-Dichloroaniline (CAS 554-00-7)...
Where can I buy 2,4-Dichloroaniline?
You can request a quote for 2,4-Dichloroaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4-Dichloroaniline?
Yes, CoreyChem provides custom synthesis services for 2,4-Dichloroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.