C18H15NO6
TL;DR: C18H15NO6 (CAS 29842-22-6) is a chemical compound with molecular formula C18H15NO6 and molecular weight 341.08994 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[3-(4-nitrophenyl)prop-2-enoyloxy]-3-phenylpropanoic acid
Also Known As: Benzenepropanoic acid, .alpha.-[[(2E)-3-(4-nitrophenyl)-1-oxo-2-propenyl]oxy]-, (.alpha.S)-, Benzenepropanoic acid, .alpha.-[[3-(4-nitrophenyl)-1-oxo-2-propenyl]oxy]-, [S-(E)]-, Benzenepropanoic acid, alpha-(((2E)-3-(4-nitrophenyl)-1-oxo-2-propenyl)oxy)-, (alphaS)-, Benzenepropanoic acid, alpha-[[(2E)-3-(4-nitrophenyl)-1-oxo-2-propenyl]oxy]-, (alphaS)-, Benzenepropanoic acid, alpha-(((2E)-3-(4-nitrophenyl)-1-oxo-2-propen-1-yl)oxy)-, (alphaS)-
Technical Specifications
| Molecular Formula | C18H15NO6 |
| Molecular Weight | 341.08994 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 109.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 341.08994 Da |
| Heavy Atoms | 25 |
| Complexity | 498.0 |
| SMILES | C1=CC=C(C=C1)CC(C(=O)O)OC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | ZCACQPQQMFRMSQ-UHFFFAOYSA-N |
Chemical Property Profile of C18H15NO6
Property Insights of C18H15NO6
The XLogP value of 3.6 indicates that C18H15NO6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C18H15NO6. Following Lipinski's Rule of Five, C18H15NO6 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of C18H15NO6?
The CAS number of C18H15NO6 is 29842-22-6.
What is the molecular formula of C18H15NO6?
The molecular formula of C18H15NO6 is C18H15NO6.
What is the molecular weight of C18H15NO6?
The molecular weight of C18H15NO6 is 341.08994 g/mol.
Where can I buy C18H15NO6?
You can request a quote for C18H15NO6 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C18H15NO6?
Yes, CoreyChem provides custom synthesis services for C18H15NO6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.