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N-[2-(dimethylamino)ethyl]benzene-1,2-diamine
TL;DR: N-[2-(dimethylamino)ethyl]benzene-1,2-diamine (CAS 78156-03-3) is a chemical compound with molecular formula C10H17N3 and molecular weight 179.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N-[2-(dimethylamino)ethyl]benzene-1,2-diamine
Also Known As: N-[2-(dimethylamino)ethyl]benzene-1,2-diamine, 1,2-Benzenediamine,N1-[2-(dimethylamino)ethyl]-, N1-[2-(dimethylamino)ethyl]benzene-1,2-diamine, 1-n-[2-(dimethylamino)ethyl]benzene-1,2-diamine, 2-N-[2-(dimethylamino)ethyl]benzene-1,2-diamine
| Molecular Formula | C10H17N3 |
|---|---|
| Molecular Weight | 179.14 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 41.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 179.14224 |
| Heavy Atoms | 13 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 78156-03-3 |
|---|---|
| SMILES | CN(C)CCNC1=CC=CC=C1N |
| InChIKey | YMYPZBOBAISUFL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-[2-(dimethylamino)ethyl]benzene-1,2-diamine (CAS 78156-03-3), with molecular formula C10H17N3 and molecular weight 179.14 g/mol. IUPAC: 2-N-[2-(dimethylamino)ethyl]benzene-1,2-diamine.
Chemical Property Profile of N-[2-(dimethylamino)ethyl]benzene-1,2-diamine
Property Insights of N-[2-(dimethylamino)ethyl]benzene-1,2-diamine
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(dimethylamino)ethyl]benzene-1,2-diamine. With a topological polar surface area (TPSA) of 41.3 Ų, N-[2-(dimethylamino)ethyl]benzene-1,2-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(dimethylamino)ethyl]benzene-1,2-diamine has 2 hydrogen bond donor(s) and 3 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-[2-(dimethylamino)ethyl]benzene-1,2-diamine?
The CAS number of N-[2-(dimethylamino)ethyl]benzene-1,2-diamine is 78156-03-3.
What is the molecular formula of N-[2-(dimethylamino)ethyl]benzene-1,2-diamine?
The molecular formula of N-[2-(dimethylamino)ethyl]benzene-1,2-diamine is C10H17N3.
What is the molecular weight of N-[2-(dimethylamino)ethyl]benzene-1,2-diamine?
The molecular weight of N-[2-(dimethylamino)ethyl]benzene-1,2-diamine is 179.14 g/mol.
Where can I buy N-[2-(dimethylamino)ethyl]benzene-1,2-diamine?
You can request a quote for N-[2-(dimethylamino)ethyl]benzene-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-[2-(dimethylamino)ethyl]benzene-1,2-diamine?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(dimethylamino)ethyl]benzene-1,2-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.