Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene
TL;DR: Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene (CAS 58952-78-6) is a chemical compound with molecular formula C13H20N2O5 and molecular weight 284.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-ethoxy-5-nitrophenyl)methyl-(2-hydroxyethyl)amino]ethanol
Also Known As: Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene, Ethanol, 2,2'-(((2-ethoxy-5-nitrophenyl)methyl)imino)bis-, 2,2'-(((2-Ethoxy-5-nitrophenyl)methyl)imino)bisethanol, 2-[(2-ethoxy-5-nitrophenyl)methyl-(2-hydroxyethyl)amino]ethanol, 2,2 -[[(2-Ethoxy-5-nitrophenyl)methyl]imino]bisethanol
| Molecular Formula | C13H20N2O5 |
|---|---|
| Molecular Weight | 284.14 g/mol |
| LogP | 0.7801 |
| Topological Polar Surface Area | 96.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 284.1372 |
| Heavy Atoms | 20 |
| Complexity | 432.76974 |
Chemical Identifiers
| CAS Number | 58952-78-6 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)[N+](=O)[O-])CN(CCO)CCO |
Product Overview
Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene (CAS 58952-78-6), with molecular formula C13H20N2O5 and molecular weight 284.14 g/mol. IUPAC: 2-[(2-ethoxy-5-nitrophenyl)methyl-(2-hydroxyethyl)amino]ethanol.
Chemical Property Profile of Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene
Property Insights of Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene
The XLogP value of 0.7801 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene. The TPSA of 96.07 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene. Following Lipinski's Rule of Five, Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene has 2 hydrogen bond donor(s) and 6 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 Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene?
The CAS number of Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene is 58952-78-6.
What is the molecular formula of Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene?
The molecular formula of Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene is C13H20N2O5.
What is the molecular weight of Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene?
The molecular weight of Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene is 284.14 g/mol.
Where can I buy Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene?
You can request a quote for Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for Bis(2-hydroxyethyl)aminomethyl-4-ethoxynitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.