![[2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate structure](/static/products/488/488131-45-9.png)
[2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate
TL;DR: [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate (CAS 488131-45-9) is a chemical compound with molecular formula C22H15NO5 and molecular weight 373.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate
Also Known As: [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate|2-((1E)-3-oxo-3-phenylprop-1-enyl)phenyl 3-nitrobenzoate|(E)-2-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate|2-[(1E)-3-oxo-3-phenylprop-1-en-1-yl]phenyl 3-nitrobenzoate
| Molecular Formula | C22H15NO5 |
|---|---|
| Molecular Weight | 373.10 g/mol |
| LogP | 4.7101 |
| Topological Polar Surface Area | 86.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 373.09503 |
| Heavy Atoms | 28 |
| Complexity | 1057.287 |
Chemical Identifiers
| CAS Number | 488131-45-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)/C=C/C2=CC=CC=C2OC(=O)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
[2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate (CAS 488131-45-9), with molecular formula C22H15NO5 and molecular weight 373.10 g/mol. IUPAC: [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate.
Chemical Property Profile of [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate
Property Insights of [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate
The XLogP value of 4.7101 indicates that [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.51 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate. Following Lipinski's Rule of Five, [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate 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-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate?
The CAS number of [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate is 488131-45-9.
What is the molecular formula of [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate?
The molecular formula of [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate is C22H15NO5.
What is the molecular weight of [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate?
The molecular weight of [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate is 373.10 g/mol.
Where can I buy [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate?
You can request a quote for [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.