![2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate structure](/static/products/2440/244081-64-9.webp)
2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate
TL;DR: 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate (CAS 244081-64-9) is a chemical compound with molecular formula C19H12BrF6NO6 and molecular weight 542.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-bromo-2-nitro-3-[3-(trifluoromethyl)benzoyl]oxypropyl] 3-(trifluoromethyl)benzoate
Also Known As: 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate, [2-bromo-2-nitro-3-[3-(trifluoromethyl)benzoyl]oxypropyl] 3-(trifluoromethyl)benzoate, 2-bromo-2-nitro-3-[3-(trifluoromethyl)benzoyloxy]propyl 3-(trifluoromethyl)benzoate
| Molecular Formula | C19H12BrF6NO6 |
|---|---|
| Molecular Weight | 542.98 g/mol |
| LogP | 5.1059 |
| Topological Polar Surface Area | 95.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 542.9752 |
| Heavy Atoms | 33 |
| Complexity | 982.054 |
Chemical Identifiers
| CAS Number | 244081-64-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C(=O)OCC(COC(=O)C2=CC(=CC=C2)C(F)(F)F)([N+](=O)[O-])Br |
Product Overview
2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate (CAS 244081-64-9), with molecular formula C19H12BrF6NO6 and molecular weight 542.98 g/mol. IUPAC: [2-bromo-2-nitro-3-[3-(trifluoromethyl)benzoyl]oxypropyl] 3-(trifluoromethyl)benzoate.
Chemical Property Profile of 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate
Property Insights of 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate
The XLogP value of 5.1059 indicates that 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate. Following Lipinski's Rule of Five, 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate?
The CAS number of 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate is 244081-64-9.
What is the molecular formula of 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate?
The molecular formula of 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate is C19H12BrF6NO6.
What is the molecular weight of 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate?
The molecular weight of 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate is 542.98 g/mol.
Where can I buy 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate?
You can request a quote for 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-bromo-2-nitro-3-{[3-(trifluoromethyl)benzoyl]oxy}propyl 3-(trifluoromethyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.