2-Bromo-6-formyl-4-nitrophenyl acetate
TL;DR: 2-Bromo-6-formyl-4-nitrophenyl acetate (CAS 378201-40-2) is a chemical compound with molecular formula C9H6BrNO5 and molecular weight 286.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-bromo-6-formyl-4-nitrophenyl) acetate
Also Known As: 2-bromo-6-formyl-4-nitrophenyl acetate, (2-bromo-6-formyl-4-nitrophenyl) acetate
| Molecular Formula | C9H6BrNO5 |
|---|---|
| Molecular Weight | 286.94 g/mol |
| LogP | 2.0951 |
| Topological Polar Surface Area | 86.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.94293 |
| Heavy Atoms | 16 |
| Complexity | 471.2123 |
Chemical Identifiers
| CAS Number | 378201-40-2 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1Br)[N+](=O)[O-])C=O |
Product Overview
2-Bromo-6-formyl-4-nitrophenyl acetate (CAS 378201-40-2), with molecular formula C9H6BrNO5 and molecular weight 286.94 g/mol. IUPAC: (2-bromo-6-formyl-4-nitrophenyl) acetate.
Chemical Property Profile of 2-Bromo-6-formyl-4-nitrophenyl acetate
Property Insights of 2-Bromo-6-formyl-4-nitrophenyl acetate
The XLogP value of 2.0951 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-6-formyl-4-nitrophenyl acetate. The TPSA of 86.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Bromo-6-formyl-4-nitrophenyl acetate. Following Lipinski's Rule of Five, 2-Bromo-6-formyl-4-nitrophenyl acetate 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 2-Bromo-6-formyl-4-nitrophenyl acetate?
The CAS number of 2-Bromo-6-formyl-4-nitrophenyl acetate is 378201-40-2.
What is the molecular formula of 2-Bromo-6-formyl-4-nitrophenyl acetate?
The molecular formula of 2-Bromo-6-formyl-4-nitrophenyl acetate is C9H6BrNO5.
What is the molecular weight of 2-Bromo-6-formyl-4-nitrophenyl acetate?
The molecular weight of 2-Bromo-6-formyl-4-nitrophenyl acetate is 286.94 g/mol.
Where can I buy 2-Bromo-6-formyl-4-nitrophenyl acetate?
You can request a quote for 2-Bromo-6-formyl-4-nitrophenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-6-formyl-4-nitrophenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-6-formyl-4-nitrophenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.