2,8-dimethyl-4-oxo-3-phenoxy-4H-chromen-7-yl acetate
TL;DR: 2,8-dimethyl-4-oxo-3-phenoxy-4H-chromen-7-yl acetate (CAS 345616-57-1) is a chemical compound with molecular formula C19H16O5 and molecular weight 324.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,8-dimethyl-4-oxo-3-phenoxychromen-7-yl) acetate
Also Known As: 2,8-dimethyl-4-oxo-3-phenoxy-4H-chromen-7-yl acetate, AF-399/33099009, (2,8-dimethyl-4-oxo-3-phenoxychromen-7-yl) acetate
| Molecular Formula | C19H16O5 |
|---|---|
| Molecular Weight | 324.10 g/mol |
| LogP | 4.12744 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.09976 |
| Heavy Atoms | 24 |
| Complexity | 970.454 |
Chemical Identifiers
| CAS Number | 345616-57-1 |
|---|---|
| SMILES | CC1=C(C=CC2=C1OC(=C(C2=O)OC3=CC=CC=C3)C)OC(=O)C |
Product Overview
2,8-dimethyl-4-oxo-3-phenoxy-4H-chromen-7-yl acetate (CAS 345616-57-1), with molecular formula C19H16O5 and molecular weight 324.10 g/mol. IUPAC: (2,8-dimethyl-4-oxo-3-phenoxychromen-7-yl) acetate.
Chemical Property Profile of 2,8-dimethyl-4-oxo-3-phenoxy-4H-chromen-7-yl acetate
Property Insights of 2,8-dimethyl-4-oxo-3-phenoxy-4H-chromen-7-yl acetate
The XLogP value of 4.12744 indicates that 2,8-dimethyl-4-oxo-3-phenoxy-4H-chromen-7-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,8-dimethyl-4-oxo-3-phenoxy-4H-chromen-7-yl acetate. Following Lipinski's Rule of Five, 2,8-dimethyl-4-oxo-3-phenoxy-4H-chromen-7-yl acetate has 0 hydrogen bond donor(s) and 5 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-4-oxo-3-phenoxy-4H-chromen-7-yl acetate?
The CAS number of 2,8-dimethyl-4-oxo-3-phenoxy-4H-chromen-7-yl acetate is 345616-57-1.
What is the molecular formula of 2,8-dimethyl-4-oxo-3-phenoxy-4H-chromen-7-yl acetate?
The molecular formula of 2,8-dimethyl-4-oxo-3-phenoxy-4H-chromen-7-yl acetate is C19H16O5.
What is the molecular weight of 2,8-dimethyl-4-oxo-3-phenoxy-4H-chromen-7-yl acetate?
The molecular weight of 2,8-dimethyl-4-oxo-3-phenoxy-4H-chromen-7-yl acetate is 324.10 g/mol.
Where can I buy 2,8-dimethyl-4-oxo-3-phenoxy-4H-chromen-7-yl acetate?
You can request a quote for 2,8-dimethyl-4-oxo-3-phenoxy-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-4-oxo-3-phenoxy-4H-chromen-7-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2,8-dimethyl-4-oxo-3-phenoxy-4H-chromen-7-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.