![2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid structure](/static/products/227/227094-67-9.png)
2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid
TL;DR: 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid (CAS 227094-67-9) is a chemical compound with molecular formula C22H20O7 and molecular weight 396.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(1,3-benzodioxol-5-yl)-2-methyl-4-oxo-6-propylchromen-7-yl]oxyacetic acid
Also Known As: 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid, 2-(3-benzo[1,3]dioxol-5-yl-2-methyl-4-oxo-6-propyl-chromen-7-yl)oxyacetic Acid, 2-[3-(1,3-benzodioxol-5-yl)-2-methyl-4-oxo-6-propylchromen-7-yl]oxyacetic acid
| Molecular Formula | C22H20O7 |
|---|---|
| Molecular Weight | 396.12 g/mol |
| LogP | 3.91302 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 396.1209 |
| Heavy Atoms | 29 |
| Complexity | 1160.015 |
Chemical Identifiers
| CAS Number | 227094-67-9 |
|---|---|
| SMILES | CCCC1=CC2=C(C=C1OCC(=O)O)OC(=C(C2=O)C3=CC4=C(C=C3)OCO4)C |
Product Overview
2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid (CAS 227094-67-9), with molecular formula C22H20O7 and molecular weight 396.12 g/mol. IUPAC: 2-[3-(1,3-benzodioxol-5-yl)-2-methyl-4-oxo-6-propylchromen-7-yl]oxyacetic acid.
Chemical Property Profile of 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid
Property Insights of 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid
The XLogP value of 3.91302 indicates that 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid. Following Lipinski's Rule of Five, 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid 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
Frequently Asked Questions
What is the CAS number of 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid?
The CAS number of 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid is 227094-67-9.
What is the molecular formula of 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid?
The molecular formula of 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid is C22H20O7.
What is the molecular weight of 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid?
The molecular weight of 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid is 396.12 g/mol.
Where can I buy 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid?
You can request a quote for 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-((3-(benzo[d][1,3]dioxol-5-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl)oxy)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.