2,3-Dichloroaniline
TL;DR: 2,3-Dichloroaniline (CAS 608-27-5) is a chemical compound with molecular formula C6H5Cl2N and molecular weight 160.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dichloroaniline
Also Known As: 2,3-DICHLOROANILINE, 2,3-Dichlorobenzenamine, Benzenamine, 2,3-dichloro-, Aniline, 2,3-dichloro-, null
| Molecular Formula | C6H5Cl2N |
|---|---|
| Molecular Weight | 160.98 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 160.9799 |
| Heavy Atoms | 9 |
| Complexity | 97.0 |
| Melting Point | 24 °C |
| Boiling Point | 252 °C |
| Density | 1.383 @ 25 °C |
| Solubility | VERY SOL IN ETHER; SLIGHTLY SOL IN PETROLEUM ETHER, BENZENE |
| Flash Point | >112 °C (closed cup) |
| Vapor Pressure | 0.02 [mmHg] |
| Refractive Index | 1.5969 at 20 °C |
Chemical Identifiers
| CAS Number | 608-27-5 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)Cl)N |
| InChIKey | BRPSAOUFIJSKOT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3-Dichloroaniline (CAS 608-27-5), with molecular formula C6H5Cl2N and molecular weight 160.98 g/mol. IUPAC: 2,3-dichloroaniline.
Chemical Property Profile of 2,3-Dichloroaniline
Property Insights of 2,3-Dichloroaniline
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dichloroaniline. With a topological polar surface area (TPSA) of 26.0 Ų, 2,3-Dichloroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-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
Frequently Asked Questions
What is the CAS number of 2,3-Dichloroaniline?
The CAS number of 2,3-Dichloroaniline is 608-27-5.
What is the molecular formula of 2,3-Dichloroaniline?
The molecular formula of 2,3-Dichloroaniline is C6H5Cl2N.
What is the molecular weight of 2,3-Dichloroaniline?
The molecular weight of 2,3-Dichloroaniline is 160.98 g/mol.
Where can I buy 2,3-Dichloroaniline?
You can request a quote for 2,3-Dichloroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dichloroaniline?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dichloroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.