Phenol, 2-amino-4-chloro-, hydrochloride (1:1)
TL;DR: Phenol, 2-amino-4-chloro-, hydrochloride (1:1) (CAS 5471-76-1) is a chemical compound with molecular formula C6H7Cl2NO and molecular weight 178.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-chlorophenol;hydrochloride
Also Known As: 2-Amino-4-chlorophenol hydrochloride, Phenol, hydrochloride, 2-amino-4-chlorophenol;hydrochloride, Phenol, 2-amino-4-chloro-, hydrochloride, 2-Amino-4-chlorphenol Hydrochlorid
| Molecular Formula | C6H7Cl2NO |
|---|---|
| Molecular Weight | 178.99 g/mol |
| LogP | 2.0496 |
| Topological Polar Surface Area | 46.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 178.99046 |
| Heavy Atoms | 10 |
| Complexity | 99.0 |
Chemical Identifiers
| CAS Number | 5471-76-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)N)O.Cl |
| InChIKey | SYIVFRRXIIRPAO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenol, 2-amino-4-chloro-, hydrochloride (1:1) (CAS 5471-76-1), with molecular formula C6H7Cl2NO and molecular weight 178.99 g/mol. IUPAC: 2-amino-4-chlorophenol;hydrochloride.
Chemical Property Profile of Phenol, 2-amino-4-chloro-, hydrochloride (1:1)
Property Insights of Phenol, 2-amino-4-chloro-, hydrochloride (1:1)
The XLogP value of 2.0496 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, 2-amino-4-chloro-, hydrochloride (1:1). With a topological polar surface area (TPSA) of 46.3 Ų, Phenol, 2-amino-4-chloro-, hydrochloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 2-amino-4-chloro-, hydrochloride (1:1) has 3 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 Phenol, 2-amino-4-chloro-, hydrochloride (1:1)?
The CAS number of Phenol, 2-amino-4-chloro-, hydrochloride (1:1) is 5471-76-1.
What is the molecular formula of Phenol, 2-amino-4-chloro-, hydrochloride (1:1)?
The molecular formula of Phenol, 2-amino-4-chloro-, hydrochloride (1:1) is C6H7Cl2NO.
What is the molecular weight of Phenol, 2-amino-4-chloro-, hydrochloride (1:1)?
The molecular weight of Phenol, 2-amino-4-chloro-, hydrochloride (1:1) is 178.99 g/mol.
Where can I buy Phenol, 2-amino-4-chloro-, hydrochloride (1:1)?
You can request a quote for Phenol, 2-amino-4-chloro-, hydrochloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 2-amino-4-chloro-, hydrochloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 2-amino-4-chloro-, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.