![8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid structure](/static/products/170/170807-22-4.png)
8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid
TL;DR: 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid (CAS 170807-22-4) is a chemical compound with molecular formula C18H14O6 and molecular weight 326.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]-4H-1,3-benzodioxine-6-carboxylic acid
Also Known As: 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid, 8-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]-4H-1,3-benzodioxine-6-carboxylic acid, (E)-8-(3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid
| Molecular Formula | C18H14O6 |
|---|---|
| Molecular Weight | 326.08 g/mol |
| LogP | 2.853 |
| Topological Polar Surface Area | 93.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.07904 |
| Heavy Atoms | 24 |
| Complexity | 837.39777 |
Chemical Identifiers
| CAS Number | 170807-22-4 |
|---|---|
| SMILES | C1C2=C(C(=CC(=C2)C(=O)O)/C=C/C(=O)C3=CC=CC=C3O)OCO1 |
Product Overview
8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid (CAS 170807-22-4), with molecular formula C18H14O6 and molecular weight 326.08 g/mol. IUPAC: 8-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]-4H-1,3-benzodioxine-6-carboxylic acid.
Chemical Property Profile of 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid
Property Insights of 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid
The XLogP value of 2.853 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid. The TPSA of 93.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid. Following Lipinski's Rule of Five, 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid has 2 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 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid?
The CAS number of 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid is 170807-22-4.
What is the molecular formula of 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid?
The molecular formula of 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid is C18H14O6.
What is the molecular weight of 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid?
The molecular weight of 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid is 326.08 g/mol.
Where can I buy 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid?
You can request a quote for 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 8-[(1E)-3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl]-4H-1,3-benzodioxine-6-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.