2'-Amino-4'-nitroacetophenone hydrochloride
TL;DR: 2'-Amino-4'-nitroacetophenone hydrochloride (CAS 56515-58-3) is a chemical compound with molecular formula C8H8N2O3 and molecular weight 180.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-amino-4-nitrophenyl)ethanone
Also Known As: 1-(2-amino-4-nitrophenyl)ethanone, 1-(2-AMINO-4-NITROPHENYL)ETHAN-1-ONE, 2'-Amino-4'-nitroacetophenone, 2-acetyl-amino-5-nitro-benzene, 1-(2-Amino-4-nitro-phenyl)-ethanone
| Molecular Formula | C8H8N2O3 |
|---|---|
| Molecular Weight | 180.05 g/mol |
| LogP | 1.3796 |
| Topological Polar Surface Area | 86.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 180.0535 |
| Heavy Atoms | 13 |
| Complexity | 373.65192 |
Chemical Identifiers
| CAS Number | 56515-58-3 |
|---|---|
| SMILES | CC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])N |
Product Overview
2'-Amino-4'-nitroacetophenone hydrochloride (CAS 56515-58-3), with molecular formula C8H8N2O3 and molecular weight 180.05 g/mol. IUPAC: 1-(2-amino-4-nitrophenyl)ethanone.
Chemical Property Profile of 2'-Amino-4'-nitroacetophenone hydrochloride
Property Insights of 2'-Amino-4'-nitroacetophenone hydrochloride
The XLogP value of 1.3796 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2'-Amino-4'-nitroacetophenone hydrochloride. The TPSA of 86.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 2'-Amino-4'-nitroacetophenone hydrochloride. Following Lipinski's Rule of Five, 2'-Amino-4'-nitroacetophenone 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-4'-nitroacetophenone hydrochloride?
The CAS number of 2'-Amino-4'-nitroacetophenone hydrochloride is 56515-58-3.
What is the molecular formula of 2'-Amino-4'-nitroacetophenone hydrochloride?
The molecular formula of 2'-Amino-4'-nitroacetophenone hydrochloride is C8H8N2O3.
What is the molecular weight of 2'-Amino-4'-nitroacetophenone hydrochloride?
The molecular weight of 2'-Amino-4'-nitroacetophenone hydrochloride is 180.05 g/mol.
Where can I buy 2'-Amino-4'-nitroacetophenone hydrochloride?
You can request a quote for 2'-Amino-4'-nitroacetophenone 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-4'-nitroacetophenone hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2'-Amino-4'-nitroacetophenone hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.