p-Phenylenediamine hydrochloride
TL;DR: p-Phenylenediamine hydrochloride (CAS 55972-71-9) is a chemical compound with molecular formula C6H9ClN2 and molecular weight 144.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzene-1,4-diamine;hydrochloride
Also Known As: p-Phenylenediamine hydrochloride, p-Phenylenediamine HCl, Fourrine DS, Pelagol CD, Pelagol Grey CD
| Molecular Formula | C6H9ClN2 |
|---|---|
| Molecular Weight | 144.05 g/mol |
| LogP | 1.27 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 144.04543 |
| Heavy Atoms | 9 |
| Complexity | 54.0 |
Chemical Identifiers
| CAS Number | 55972-71-9 |
|---|---|
| SMILES | C1=CC(=CC=C1N)N.Cl |
| InChIKey | MCIURFJELJKSNV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
p-Phenylenediamine hydrochloride (CAS 55972-71-9), with molecular formula C6H9ClN2 and molecular weight 144.05 g/mol. IUPAC: benzene-1,4-diamine;hydrochloride.
Chemical Property Profile of p-Phenylenediamine hydrochloride
Property Insights of p-Phenylenediamine hydrochloride
The XLogP value of 1.27 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Phenylenediamine hydrochloride. With a topological polar surface area (TPSA) of 52.0 Ų, p-Phenylenediamine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Phenylenediamine hydrochloride 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 p-Phenylenediamine hydrochloride?
The CAS number of p-Phenylenediamine hydrochloride is 55972-71-9.
What is the molecular formula of p-Phenylenediamine hydrochloride?
The molecular formula of p-Phenylenediamine hydrochloride is C6H9ClN2.
What is the molecular weight of p-Phenylenediamine hydrochloride?
The molecular weight of p-Phenylenediamine hydrochloride is 144.05 g/mol.
Where can I buy p-Phenylenediamine hydrochloride?
You can request a quote for p-Phenylenediamine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Phenylenediamine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for p-Phenylenediamine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.