4-Chloronaphthylamine
TL;DR: 4-Chloronaphthylamine (CAS 4684-12-2) is a chemical compound with molecular formula C10H8ClN and molecular weight 177.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloronaphthalen-1-amine
Also Known As: 1-Amino-4-chloronaphthalene, 4-chloronaphthalen-1-amine, 4-Chloronaphthylamine, 4-Chloro-1-naphthalenamine, 4-Chloro-1-naphthylamine
| Molecular Formula | C10H8ClN |
|---|---|
| Molecular Weight | 177.03 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 177.03453 |
| Heavy Atoms | 12 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 4684-12-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC=C2Cl)N |
| InChIKey | DEPDZGNUVOAZCW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloronaphthylamine (CAS 4684-12-2), with molecular formula C10H8ClN and molecular weight 177.03 g/mol. IUPAC: 4-chloronaphthalen-1-amine.
Chemical Property Profile of 4-Chloronaphthylamine
Property Insights of 4-Chloronaphthylamine
The XLogP value of 3.4 indicates that 4-Chloronaphthylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, 4-Chloronaphthylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloronaphthylamine 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 4-Chloronaphthylamine?
The CAS number of 4-Chloronaphthylamine is 4684-12-2.
What is the molecular formula of 4-Chloronaphthylamine?
The molecular formula of 4-Chloronaphthylamine is C10H8ClN.
What is the molecular weight of 4-Chloronaphthylamine?
The molecular weight of 4-Chloronaphthylamine is 177.03 g/mol.
Where can I buy 4-Chloronaphthylamine?
You can request a quote for 4-Chloronaphthylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloronaphthylamine?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloronaphthylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.