2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone
TL;DR: 2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone (CAS 65447-49-6) is a chemical compound with molecular formula C9H8BrNO4 and molecular weight 272.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-1-(4-methoxy-3-nitrophenyl)ethanone
Also Known As: 2-bromo-1-(4-methoxy-3-nitrophenyl)ethanone, 2-bromo-1-(4-methoxy-3-nitrophenyl)-1-ethanone, 2-bromo-1-(4-methoxy-3-nitrophenyl)ethan-1-one, 7487AE, 2-bromo-3'-nitro-4'-methoxyacetophenone
| Molecular Formula | C9H8BrNO4 |
|---|---|
| Molecular Weight | 272.96 g/mol |
| LogP | 2.181 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 272.96368 |
| Heavy Atoms | 15 |
| Complexity | 405.09885 |
Chemical Identifiers
| CAS Number | 65447-49-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)CBr)[N+](=O)[O-] |
Product Overview
2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone (CAS 65447-49-6), with molecular formula C9H8BrNO4 and molecular weight 272.96 g/mol. IUPAC: 2-bromo-1-(4-methoxy-3-nitrophenyl)ethanone.
Chemical Property Profile of 2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone
Property Insights of 2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone
The XLogP value of 2.181 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone. The TPSA of 69.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone. Following Lipinski's Rule of Five, 2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone has 0 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-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone?
The CAS number of 2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone is 65447-49-6.
What is the molecular formula of 2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone?
The molecular formula of 2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone is C9H8BrNO4.
What is the molecular weight of 2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone?
The molecular weight of 2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone is 272.96 g/mol.
Where can I buy 2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone?
You can request a quote for 2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-1-(4-methoxy-3-nitrophenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.