N,N-Diethyl-p-phenylenediamine hydrochloride
TL;DR: N,N-Diethyl-p-phenylenediamine hydrochloride (CAS 2198-58-5) is a chemical compound with molecular formula C10H17ClN2 and molecular weight 200.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N,4-N-diethylbenzene-1,4-diamine;hydrochloride
Also Known As: N1,N1-Diethylbenzene-1,4-diamine hydrochloride, 1,4-Benzenediamine, N,N-diethyl-, monohydrochloride, CD 1, N,N-Diethyl-p-phenylenediamine hydrochloride, p-Amino diethylaniline hydrochloride
| Molecular Formula | C10H17ClN2 |
|---|---|
| Molecular Weight | 200.11 g/mol |
| LogP | 2.54 |
| Topological Polar Surface Area | 29.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.10803 |
| Heavy Atoms | 13 |
| Complexity | 113.0 |
Chemical Identifiers
| CAS Number | 2198-58-5 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)N.Cl |
| InChIKey | XTBFKMDOQMQYPP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-Diethyl-p-phenylenediamine hydrochloride (CAS 2198-58-5), with molecular formula C10H17ClN2 and molecular weight 200.11 g/mol. IUPAC: 4-N,4-N-diethylbenzene-1,4-diamine;hydrochloride.
Chemical Property Profile of N,N-Diethyl-p-phenylenediamine hydrochloride
Property Insights of N,N-Diethyl-p-phenylenediamine hydrochloride
The XLogP value of 2.54 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Diethyl-p-phenylenediamine hydrochloride. With a topological polar surface area (TPSA) of 29.3 Ų, N,N-Diethyl-p-phenylenediamine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Diethyl-p-phenylenediamine hydrochloride has 2 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 N,N-Diethyl-p-phenylenediamine hydrochloride?
The CAS number of N,N-Diethyl-p-phenylenediamine hydrochloride is 2198-58-5.
What is the molecular formula of N,N-Diethyl-p-phenylenediamine hydrochloride?
The molecular formula of N,N-Diethyl-p-phenylenediamine hydrochloride is C10H17ClN2.
What is the molecular weight of N,N-Diethyl-p-phenylenediamine hydrochloride?
The molecular weight of N,N-Diethyl-p-phenylenediamine hydrochloride is 200.11 g/mol.
Where can I buy N,N-Diethyl-p-phenylenediamine hydrochloride?
You can request a quote for N,N-Diethyl-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 N,N-Diethyl-p-phenylenediamine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for N,N-Diethyl-p-phenylenediamine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.