Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)-
TL;DR: Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)- (CAS 4101-32-0) is a chemical compound with molecular formula C10H11NO5 and molecular weight 225.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,5-dimethoxy-2-nitrophenyl)ethanone
Also Known As: 1-(4,5-Dimethoxy-2-nitrophenyl)ethanone, 4',5'-dimethoxy-2'-nitroacetophenone, 1-(4,5-Dimethoxy-2-nitro-phenyl)-ethanone, 3',4'-dimethoxy-6'-nitroacetophenone, Cabozantinib Impurity 10
| Molecular Formula | C10H11NO5 |
|---|---|
| Molecular Weight | 225.06 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.06372 |
| Heavy Atoms | 16 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 4101-32-0 |
|---|---|
| SMILES | CC(=O)C1=CC(=C(C=C1[N+](=O)[O-])OC)OC |
| InChIKey | ZVLFGESHYMKNQP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)- (CAS 4101-32-0), with molecular formula C10H11NO5 and molecular weight 225.06 g/mol. IUPAC: 1-(4,5-dimethoxy-2-nitrophenyl)ethanone.
Chemical Property Profile of Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)-
Property Insights of Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)-. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)-. Following Lipinski's Rule of Five, Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)- has 0 hydrogen bond donor(s) and 5 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 Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)-?
The CAS number of Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)- is 4101-32-0.
What is the molecular formula of Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)-?
The molecular formula of Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)- is C10H11NO5.
What is the molecular weight of Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)-?
The molecular weight of Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)- is 225.06 g/mol.
Where can I buy Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)-?
You can request a quote for Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(4,5-dimethoxy-2-nitrophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.