2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride
TL;DR: 2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride (CAS 4740-22-1) is a chemical compound with molecular formula C8H9ClN2O3 and molecular weight 216.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-(4-nitrophenyl)ethanone;hydrochloride
Also Known As: 2-amino-1-(4-nitrophenyl)ethanone Hydrochloride, 2-Amino-p-nitro-acetophenone HCl, 2-Amino-(4'-nitro)acetophenone hydrochloride, 2-Amino-p-nitro-acetophenone hydrochloride, 2-Amino-4'-nitroacetophenone HCl
| Molecular Formula | C8H9ClN2O3 |
|---|---|
| Molecular Weight | 216.03 g/mol |
| LogP | 1.158 |
| Topological Polar Surface Area | 86.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.03017 |
| Heavy Atoms | 14 |
| Complexity | 336.94455 |
Chemical Identifiers
| CAS Number | 4740-22-1 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)CN)[N+](=O)[O-].Cl |
Product Overview
2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride (CAS 4740-22-1), with molecular formula C8H9ClN2O3 and molecular weight 216.03 g/mol. IUPAC: 2-amino-1-(4-nitrophenyl)ethanone;hydrochloride.
Chemical Property Profile of 2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride
Property Insights of 2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride
The XLogP value of 1.158 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride. The TPSA of 86.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride. Following Lipinski's Rule of Five, 2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride has 1 hydrogen bond donor(s) and 4 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 2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride?
The CAS number of 2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride is 4740-22-1.
What is the molecular formula of 2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride?
The molecular formula of 2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride is C8H9ClN2O3.
What is the molecular weight of 2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride?
The molecular weight of 2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride is 216.03 g/mol.
Where can I buy 2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride?
You can request a quote for 2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-1-(4-nitrophenyl)ethan-1-one hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.