2-Chloro-p-toluidine
TL;DR: 2-Chloro-p-toluidine (CAS 615-65-6) is a chemical compound with molecular formula C7H8ClN and molecular weight 141.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4-methylaniline
Also Known As: 2-Chloro-4-methylaniline, 2-CHLORO-P-TOLUIDINE, 4-Amino-3-chlorotoluene, p-Toluidine, 2-chloro-, Benzenamine, 2-chloro-4-methyl-
| Molecular Formula | C7H8ClN |
|---|---|
| Molecular Weight | 141.03 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 141.03453 |
| Heavy Atoms | 9 |
| Complexity | 94.0 |
| Melting Point | 7 °C |
| Boiling Point | 219 °C @ 732 MM HG |
| Density | 1.151 @ 20 °C |
| Solubility | SLIGHTLY SOL IN WATER, ACETONE |
| Refractive Index | 1.5748 @ 22 °C |
Chemical Identifiers
| CAS Number | 615-65-6 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N)Cl |
| InChIKey | XGYLSRFSXKAYCR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloro-p-toluidine (CAS 615-65-6), with molecular formula C7H8ClN and molecular weight 141.03 g/mol. IUPAC: 2-chloro-4-methylaniline.
Chemical Property Profile of 2-Chloro-p-toluidine
Property Insights of 2-Chloro-p-toluidine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-p-toluidine. With a topological polar surface area (TPSA) of 26.0 Ų, 2-Chloro-p-toluidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-p-toluidine 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-Chloro-p-toluidine?
The CAS number of 2-Chloro-p-toluidine is 615-65-6.
What is the molecular formula of 2-Chloro-p-toluidine?
The molecular formula of 2-Chloro-p-toluidine is C7H8ClN.
What is the molecular weight of 2-Chloro-p-toluidine?
The molecular weight of 2-Chloro-p-toluidine is 141.03 g/mol.
Where can I buy 2-Chloro-p-toluidine?
You can request a quote for 2-Chloro-p-toluidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-p-toluidine?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-p-toluidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.