alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride
TL;DR: alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride (CAS 131961-45-0) is a chemical compound with molecular formula C12H19ClN2O4 and molecular weight 290.10333 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(dimethylamino)ethoxy]-1-(3-nitrophenyl)ethanol;hydrochloride
Also Known As: alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride, Benzenemethanol, alpha-((2-(dimethylamino)ethoxy)methyl)-3-nitro-, monohydrochloride, 2-[2-(dimethylamino)ethoxy]-1-(3-nitrophenyl)ethanol,hydrochloride, 2-(2-dimethylaminoethyloxy)-1-(3-nitrophenyl)ethanol hydrochloride, 2-[2-(Dimethylamino)ethoxy]-1-(3-nitrophenyl)ethan-1-ol--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C12H19ClN2O4 |
| Molecular Weight | 290.10333 g/mol |
| XLogP | 1.6282 |
| Topological Polar Surface Area (TPSA) | 78.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 290.10333 Da |
| Heavy Atoms | 19 |
| Complexity | 255.0 |
| SMILES | CN(C)CCOCC(C1=CC(=CC=C1)[N+](=O)[O-])O.Cl |
| InChIKey | GUBMSZUOSARNDL-UHFFFAOYSA-N |
Chemical Property Profile of alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride
Property Insights of alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride
The XLogP value of 1.6282 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride. Following Lipinski's Rule of Five, alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride?
The CAS number of alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride is 131961-45-0.
What is the molecular formula of alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride?
The molecular formula of alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride is C12H19ClN2O4.
What is the molecular weight of alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride?
The molecular weight of alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride is 290.10333 g/mol.
Where can I buy alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride?
You can request a quote for alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride?
Yes, CoreyChem provides custom synthesis services for alpha-((2-(Dimethylamino)ethoxy)methyl)-3-nitrobenzenemethanol monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.