Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride
TL;DR: Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride (CAS 77905-45-4) is a chemical compound with molecular formula C12H19ClN2O5 and molecular weight 306.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-hydroxyethyl)-[(4-methoxy-3-nitrophenyl)methyl]azanium chloride
Also Known As: 2,2'-((4-Methoxy-3-nitrobenzyl)imino)diethanol hydrochloride, 4-Methoxy-3-nitrobenzyl-bis(2-hydroxyethyl)amine hydrochloride, ETHANOL, 2,2'-((4-METHOXY-3-NITROBENZYL)IMINO)DI-, HYDROCHLORIDE, bis(2-hydroxyethyl)-[(4-methoxy-3-nitrophenyl)methyl]azanium chloride, bis(2-hydroxyethyl)-[(4-methoxy-3-nitrophenyl)methyl]azanium;chloride
| Molecular Formula | C12H19ClN2O5 |
|---|---|
| Molecular Weight | 306.10 g/mol |
| LogP | -4.02 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 306.09824 |
| Heavy Atoms | 20 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 77905-45-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C[NH+](CCO)CCO)[N+](=O)[O-].[Cl-] |
| InChIKey | OFIBISYBGYZHGJ-UHFFFAOYSA-N |
Product Overview
Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride (CAS 77905-45-4), with molecular formula C12H19ClN2O5 and molecular weight 306.10 g/mol. IUPAC: bis(2-hydroxyethyl)-[(4-methoxy-3-nitrophenyl)methyl]azanium chloride.
Chemical Property Profile of Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride
Property Insights of Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride
The XLogP value of -4.02 indicates that Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride. Following Lipinski's Rule of Five, Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride has 3 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 Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride?
The CAS number of Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride is 77905-45-4.
What is the molecular formula of Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride?
The molecular formula of Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride is C12H19ClN2O5.
What is the molecular weight of Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride?
The molecular weight of Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride is 306.10 g/mol.
Where can I buy Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride?
You can request a quote for Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ethanol, 2,2'-((4-methoxy-3-nitrobenzyl)imino)di-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.