1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2)
TL;DR: 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2) (CAS 54749-07-4) is a chemical compound with molecular formula C11H20Cl2N2 and molecular weight 250.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N,4-N-diethyl-2-methylbenzene-1,4-diamine;dihydrochloride
Also Known As: N,N-Diethyltoluene-2,5-diamine dihydrochloride, 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, dihydrochloride, 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2), N4,N4-Diethyl-2-methyl-1,4-phenylenediammonium dichloride, 4-N,4-N-diethyl-2-methylbenzene-1,4-diamine;dihydrochloride
| Molecular Formula | C11H20Cl2N2 |
|---|---|
| Molecular Weight | 250.10 g/mol |
| LogP | 3.26702 |
| Topological Polar Surface Area | 29.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.10036 |
| Heavy Atoms | 15 |
| Complexity | 285.91644 |
Chemical Identifiers
| CAS Number | 54749-07-4 |
|---|---|
| SMILES | CCN(CC)C1=CC(=C(C=C1)N)C.Cl.Cl |
Product Overview
1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2) (CAS 54749-07-4), with molecular formula C11H20Cl2N2 and molecular weight 250.10 g/mol. IUPAC: 4-N,4-N-diethyl-2-methylbenzene-1,4-diamine;dihydrochloride.
Chemical Property Profile of 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2)
Property Insights of 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2)
The XLogP value of 3.26702 indicates that 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.26 Ų, 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2) 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 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2)?
The CAS number of 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2) is 54749-07-4.
What is the molecular formula of 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2)?
The molecular formula of 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2) is C11H20Cl2N2.
What is the molecular weight of 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2)?
The molecular weight of 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2) is 250.10 g/mol.
Where can I buy 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2)?
You can request a quote for 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2)?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Benzenediamine, N4,N4-diethyl-2-methyl-, hydrochloride (1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.