o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride
TL;DR: o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride (CAS 101976-54-9) is a chemical compound with molecular formula C12H23Cl2N3 and molecular weight 279.13 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;dihydrochloride
Also Known As: N-(2-Diethylaminoethyl)-o-phenylenediamine, dihydrochloride, o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride, 2-N-(2-diethylaminoethyl)benzene-1,2-diamine dihydrochloride, 2-N-[2-(diethylamino)ethyl]benzene-1,2-diamine,dihydrochloride, N~1~-[2-(Diethylamino)ethyl]benzene-1,2-diamine--hydrogen chloride (1/2)
| Molecular Formula | C12H23Cl2N3 |
|---|---|
| Molecular Weight | 279.13 g/mol |
| LogP | 2.8661 |
| Topological Polar Surface Area | 41.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 279.1269 |
| Heavy Atoms | 17 |
| Complexity | 290.83417 |
Chemical Identifiers
| CAS Number | 101976-54-9 |
|---|---|
| SMILES | CCN(CC)CCNC1=CC=CC=C1N.Cl.Cl |
Product Overview
o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride (CAS 101976-54-9), with molecular formula C12H23Cl2N3 and molecular weight 279.13 g/mol. IUPAC: 2-N-[2-(diethylamino)ethyl]benzene-1,2-diamine;dihydrochloride.
Chemical Property Profile of o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride
Property Insights of o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride
The XLogP value of 2.8661 suggests moderate lipophilicity, balancing water solubility and membrane permeability for o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride. With a topological polar surface area (TPSA) of 41.29 Ų, o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride 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 o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride?
The CAS number of o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride is 101976-54-9.
What is the molecular formula of o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride?
The molecular formula of o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride is C12H23Cl2N3.
What is the molecular weight of o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride?
The molecular weight of o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride is 279.13 g/mol.
Where can I buy o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride?
You can request a quote for o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for o-Phenylenediamine, N-(2-(diethylamino)ethyl)-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.