2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate
TL;DR: 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate (CAS 315233-71-7) 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.
[2,8-dimethyl-3-(2-methylphenyl)-4-oxochromen-7-yl] acetate
Also Known As: ChemDiv3_001488, IDI1_020454, 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate, F0758-0061, AF-399/14945588
| Molecular Formula | C20H18O4 |
|---|---|
| Molecular Weight | 322.12 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.1205 |
| Heavy Atoms | 24 |
| Complexity | 550.0 |
Chemical Identifiers
| CAS Number | 315233-71-7 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=C(OC3=C(C2=O)C=CC(=C3C)OC(=O)C)C |
| InChIKey | JHZFQFGFYSOHPC-UHFFFAOYSA-N |
Product Overview
2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate (CAS 315233-71-7), with molecular formula C20H18O4 and molecular weight 322.12 g/mol. IUPAC: [2,8-dimethyl-3-(2-methylphenyl)-4-oxochromen-7-yl] acetate.
Chemical Property Profile of 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate
Property Insights of 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate
The XLogP value of 4.0 indicates that 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate 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 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate?
The CAS number of 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate is 315233-71-7.
What is the molecular formula of 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate?
The molecular formula of 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate is C20H18O4.
What is the molecular weight of 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate?
The molecular weight of 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate is 322.12 g/mol.
Where can I buy 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate?
You can request a quote for 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2,8-dimethyl-3-(2-methylphenyl)-4-oxo-4H-chromen-7-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.