![N1-[2-(diethylamino)ethyl]benzene-1,2-diamine structure](/static/products/4051/40516-96-9.webp)
N1-[2-(diethylamino)ethyl]benzene-1,2-diamine
TL;DR: N1-[2-(diethylamino)ethyl]benzene-1,2-diamine (CAS 40516-96-9) is a chemical compound with molecular formula C12H21N3 and molecular weight 207.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N-[2-(diethylamino)ethyl]benzene-1,2-diamine
Also Known As: N1-[2-(diethylamino)ethyl]benzene-1,2-diamine, N-(2-diethylaminoethyl)benzene-1,2-diamine, 2-N-(2-diethylaminoethyl)benzene-1,2-diamine, N-(2-diethylamino-ethyl)-benzene-1,2-diamine, N1-(2-(Diethylamino)ethyl)benzene-1,2-diamine
| Molecular Formula | C12H21N3 |
|---|---|
| Molecular Weight | 207.17 g/mol |
| LogP | 2.0225 |
| Topological Polar Surface Area | 41.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 207.17355 |
| Heavy Atoms | 15 |
| Complexity | 281.95065 |
Chemical Identifiers
| CAS Number | 40516-96-9 |
|---|---|
| SMILES | CCN(CC)CCNC1=CC=CC=C1N |
Product Overview
N1-[2-(diethylamino)ethyl]benzene-1,2-diamine (CAS 40516-96-9), with molecular formula C12H21N3 and molecular weight 207.17 g/mol. IUPAC: 2-N-[2-(diethylamino)ethyl]benzene-1,2-diamine.
Chemical Property Profile of N1-[2-(diethylamino)ethyl]benzene-1,2-diamine
Property Insights of N1-[2-(diethylamino)ethyl]benzene-1,2-diamine
The XLogP value of 2.0225 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1-[2-(diethylamino)ethyl]benzene-1,2-diamine. With a topological polar surface area (TPSA) of 41.29 Ų, N1-[2-(diethylamino)ethyl]benzene-1,2-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1-[2-(diethylamino)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 N1-[2-(diethylamino)ethyl]benzene-1,2-diamine?
The CAS number of N1-[2-(diethylamino)ethyl]benzene-1,2-diamine is 40516-96-9.
What is the molecular formula of N1-[2-(diethylamino)ethyl]benzene-1,2-diamine?
The molecular formula of N1-[2-(diethylamino)ethyl]benzene-1,2-diamine is C12H21N3.
What is the molecular weight of N1-[2-(diethylamino)ethyl]benzene-1,2-diamine?
The molecular weight of N1-[2-(diethylamino)ethyl]benzene-1,2-diamine is 207.17 g/mol.
Where can I buy N1-[2-(diethylamino)ethyl]benzene-1,2-diamine?
You can request a quote for N1-[2-(diethylamino)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 N1-[2-(diethylamino)ethyl]benzene-1,2-diamine?
Yes, KEHONG BIO provides custom synthesis services for N1-[2-(diethylamino)ethyl]benzene-1,2-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.