N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine
TL;DR: N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine (CAS 6303-47-5) is a chemical compound with molecular formula C12H19ClN2 and molecular weight 226.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)-N',N'-diethylethane-1,2-diamine
Also Known As: 2-m-Chloranilino-ethyl-diethylamin, N'-(3-Chlorophenyl)-N,N-diethyl-1,2-ethanediamine, n'-(3-chlorophenyl)-n,n-diethylethane-1,2-diamine, Benzeneacetic acid,2-(3-amino-1,3-dioxopropyl), N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine
| Molecular Formula | C12H19ClN2 |
|---|---|
| Molecular Weight | 226.12 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 15.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 226.12367 |
| Heavy Atoms | 15 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 6303-47-5 |
|---|---|
| SMILES | CCN(CC)CCNC1=CC(=CC=C1)Cl |
| InChIKey | ZZKMDVYMXCIPIF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine (CAS 6303-47-5), with molecular formula C12H19ClN2 and molecular weight 226.12 g/mol. IUPAC: N-(3-chlorophenyl)-N',N'-diethylethane-1,2-diamine.
Chemical Property Profile of N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine
Property Insights of N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine
The XLogP value of 3.3 indicates that N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.3 Ų, N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine 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 N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine?
The CAS number of N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine is 6303-47-5.
What is the molecular formula of N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine?
The molecular formula of N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine is C12H19ClN2.
What is the molecular weight of N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine?
The molecular weight of N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine is 226.12 g/mol.
Where can I buy N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine?
You can request a quote for N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine?
Yes, KEHONG BIO provides custom synthesis services for N'-(3-Chloro-phenyl)-N,N-diethyl-ethane-1,2-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.