5-Chloro-2-methoxyaniline
TL;DR: 5-Chloro-2-methoxyaniline (CAS 95-03-4) is a chemical compound with molecular formula C7H8ClNO and molecular weight 157.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-methoxyaniline
Also Known As: 5-Chloro-2-methoxyaniline, 5-Chloro-o-anisidine, 2-Amino-4-chloroanisole, 5-Chloroanisidine, Tulabase Fast Red R
| Molecular Formula | C7H8ClNO |
|---|---|
| Molecular Weight | 157.03 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 157.02943 |
| Heavy Atoms | 10 |
| Complexity | 110.0 |
Chemical Identifiers
| CAS Number | 95-03-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)N |
| InChIKey | WBSMIPLNPSCJFS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Chloro-2-methoxyaniline (CAS 95-03-4), with molecular formula C7H8ClNO and molecular weight 157.03 g/mol. IUPAC: 5-chloro-2-methoxyaniline.
Chemical Property Profile of 5-Chloro-2-methoxyaniline
Property Insights of 5-Chloro-2-methoxyaniline
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-2-methoxyaniline. With a topological polar surface area (TPSA) of 35.3 Ų, 5-Chloro-2-methoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-2-methoxyaniline has 1 hydrogen bond donor(s) and 2 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-methoxyaniline?
The CAS number of 5-Chloro-2-methoxyaniline is 95-03-4.
What is the molecular formula of 5-Chloro-2-methoxyaniline?
The molecular formula of 5-Chloro-2-methoxyaniline is C7H8ClNO.
What is the molecular weight of 5-Chloro-2-methoxyaniline?
The molecular weight of 5-Chloro-2-methoxyaniline is 157.03 g/mol.
Where can I buy 5-Chloro-2-methoxyaniline?
You can request a quote for 5-Chloro-2-methoxyaniline 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-methoxyaniline?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-2-methoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.