![alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid structure](/static/products/285/285136-03-0.png)
alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid
TL;DR: alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid (CAS 285136-03-0) is a chemical compound with molecular formula C18H16O9 and molecular weight 376.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(E)-2-carboxyethenyl]-2-hydroxyphenoxy]-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid
Also Known As: alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid, (E)-3-[4-[1-carboxy-2-(3,4-dihydroxyphenyl)-2-hydroxy-ethoxy]-3-hydroxy-phenyl]prop-2-enoic Acid
| Molecular Formula | C18H16O9 |
|---|---|
| Molecular Weight | 376.08 g/mol |
| LogP | 1.4668 |
| Topological Polar Surface Area | 164.75 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 376.07944 |
| Heavy Atoms | 27 |
| Complexity | 888.3962 |
Chemical Identifiers
| CAS Number | 285136-03-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1/C=C/C(=O)O)O)OC(C(C2=CC(=C(C=C2)O)O)O)C(=O)O |
Product Overview
alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid (CAS 285136-03-0), with molecular formula C18H16O9 and molecular weight 376.08 g/mol. IUPAC: 2-[4-[(E)-2-carboxyethenyl]-2-hydroxyphenoxy]-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid.
Chemical Property Profile of alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid
Property Insights of alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid
The XLogP value of 1.4668 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid. The TPSA of 164.75 Ų indicates high polarity, suggesting alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid has 6 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid?
The CAS number of alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid is 285136-03-0.
What is the molecular formula of alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid?
The molecular formula of alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid is C18H16O9.
What is the molecular weight of alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid?
The molecular weight of alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid is 376.08 g/mol.
Where can I buy alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid?
You can request a quote for alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.