3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one
TL;DR: 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one (CAS 859658-52-9) is a chemical compound with molecular formula C20H18O4 and molecular weight 322.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methoxyphenyl)-7-(2-methylprop-2-enoxy)chromen-2-one
Also Known As: 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one, 3-(4-methoxyphenyl)-7-(2-methylprop-2-enoxy)chromen-2-one, 3-(4-methoxyphenyl)-7-[(2-methylprop-2-en-1-yl)oxy]-2H-chromen-2-one, F1862-0223, 3-(4-methoxyphenyl)-7-(2-methylprop-2-enyloxy)chromen-2-one
| Molecular Formula | C20H18O4 |
|---|---|
| Molecular Weight | 322.12 g/mol |
| LogP | 4.4235 |
| Topological Polar Surface Area | 48.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.1205 |
| Heavy Atoms | 24 |
| Complexity | 936.00525 |
Chemical Identifiers
| CAS Number | 859658-52-9 |
|---|---|
| SMILES | CC(=C)COC1=CC2=C(C=C1)C=C(C(=O)O2)C3=CC=C(C=C3)OC |
Product Overview
3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one (CAS 859658-52-9), with molecular formula C20H18O4 and molecular weight 322.12 g/mol. IUPAC: 3-(4-methoxyphenyl)-7-(2-methylprop-2-enoxy)chromen-2-one.
Chemical Property Profile of 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one
Property Insights of 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one
The XLogP value of 4.4235 indicates that 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.67 Ų, 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one has 0 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 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one?
The CAS number of 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one is 859658-52-9.
What is the molecular formula of 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one?
The molecular formula of 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one is C20H18O4.
What is the molecular weight of 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one?
The molecular weight of 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one is 322.12 g/mol.
Where can I buy 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one?
You can request a quote for 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-methoxyphenyl)-7-((2-methylallyl)oxy)-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.