3,5-Dichloroaniline
TL;DR: 3,5-Dichloroaniline (CAS 626-43-7) 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.
3,5-dichloroaniline
Also Known As: 3,5-DICHLOROANILINE, m-Dichloroaniline, Benzenamine, 3,5-dichloro-, 3,5-Dichlorobenzenamine, Aniline, 3,5-dichloro-
| 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 | 87.0 |
| Melting Point | 51-53 °C |
| Boiling Point | 260 °C @ 741 mm Hg |
| Density | 1.58 |
| Solubility | INSOL IN WATER; SOL IN HOT PETROLEUM ETHER |
| Vapor Pressure | 0.02 [mmHg] |
Chemical Identifiers
| CAS Number | 626-43-7 |
|---|---|
| SMILES | C1=C(C=C(C=C1Cl)Cl)N |
| InChIKey | UQRLKWGPEVNVHT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-Dichloroaniline (CAS 626-43-7), with molecular formula C6H5Cl2N and molecular weight 160.98 g/mol. IUPAC: 3,5-dichloroaniline.
Chemical Property Profile of 3,5-Dichloroaniline
Property Insights of 3,5-Dichloroaniline
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dichloroaniline. With a topological polar surface area (TPSA) of 26.0 Ų, 3,5-Dichloroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-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 3,5-Dichloroaniline?
The CAS number of 3,5-Dichloroaniline is 626-43-7.
What is the molecular formula of 3,5-Dichloroaniline?
The molecular formula of 3,5-Dichloroaniline is C6H5Cl2N.
What is the molecular weight of 3,5-Dichloroaniline?
The molecular weight of 3,5-Dichloroaniline is 160.98 g/mol.
Where can I buy 3,5-Dichloroaniline?
You can request a quote for 3,5-Dichloroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dichloroaniline?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dichloroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.