(E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid
TL;DR: (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid (CAS 858754-39-9) is a chemical compound with molecular formula C23H22O5 and molecular weight 378.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4,8-dimethyl-2-oxo-7-[(E)-3-phenylprop-2-enoxy]chromen-3-yl]propanoic acid
Also Known As: (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid, 3-(4,8-dimethyl-2-oxo-7-{[(2E)-3-phenylprop-2-en-1-yl]oxy}-2H-chromen-3-yl)propanoic acid, 3-(7-cinnamyloxy-4,8-dimethyl-2-oxo-chromen-3-yl)propanoic Acid, 3-[4,8-dimethyl-2-oxo-7-[(E)-3-phenylprop-2-enoxy]chromen-3-yl]propanoic acid
| Molecular Formula | C23H22O5 |
|---|---|
| Molecular Weight | 378.15 g/mol |
| LogP | 4.51924 |
| Topological Polar Surface Area | 76.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 378.14673 |
| Heavy Atoms | 28 |
| Complexity | 1077.5833 |
Chemical Identifiers
| CAS Number | 858754-39-9 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2C)OC/C=C/C3=CC=CC=C3)CCC(=O)O |
Product Overview
(E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid (CAS 858754-39-9), with molecular formula C23H22O5 and molecular weight 378.15 g/mol. IUPAC: 3-[4,8-dimethyl-2-oxo-7-[(E)-3-phenylprop-2-enoxy]chromen-3-yl]propanoic acid.
Chemical Property Profile of (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid
Property Insights of (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid
The XLogP value of 4.51924 indicates that (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.74 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid. Following Lipinski's Rule of Five, (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid has 1 hydrogen bond donor(s) and 4 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 (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid?
The CAS number of (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid is 858754-39-9.
What is the molecular formula of (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid?
The molecular formula of (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid is C23H22O5.
What is the molecular weight of (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid?
The molecular weight of (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid is 378.15 g/mol.
Where can I buy (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid?
You can request a quote for (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(7-(cinnamyloxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.