(E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one
TL;DR: (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one (CAS 149744-45-6) is a chemical compound with molecular formula C17H12ClNO6 and molecular weight 361.0353 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one
Also Known As: (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one, (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-benzo[d][1,3]dioxin-8-yl)prop-2-en-1-one
Technical Specifications
| Molecular Formula | C17H12ClNO6 |
| Molecular Weight | 361.0353 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 361.0353 Da |
| Heavy Atoms | 25 |
| Complexity | 536.0 |
| SMILES | C1C2=C(C(=CC(=C2)[N+](=O)[O-])/C=C/C(=O)C3=C(C=CC(=C3)Cl)O)OCO1 |
| InChIKey | WCAYFKKSHNUPEM-HNQUOIGGSA-N |
Chemical Property Profile of (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one
Property Insights of (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one
The XLogP value of 3.8 indicates that (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one. Following Lipinski's Rule of Five, (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one 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 (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one?
The CAS number of (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one is 149744-45-6.
What is the molecular formula of (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one?
The molecular formula of (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one is C17H12ClNO6.
What is the molecular weight of (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one?
The molecular weight of (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one is 361.0353 g/mol.
Where can I buy (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one?
You can request a quote for (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one?
Yes, CoreyChem provides custom synthesis services for (E)-1-(5-chloro-2-hydroxyphenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.