Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester
TL;DR: Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester (CAS 1508-89-0) is a chemical compound with molecular formula C23H16O4 and molecular weight 356.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxo-3,4-diphenylchromen-7-yl) acetate
Also Known As: 7-Acetoxy-3,4-diphenyl-cumarin, 7-acetoxy-3,4-diphenyl-chromen-2-one, (2-oxo-3,4-diphenylchromen-7-yl) acetate, 3,4-Diphenyl-7-hydroxycoumarin acetate (ester), 2-oxo-3,4-diphenyl-2H-chromen-7-yl acetate
| Molecular Formula | C23H16O4 |
|---|---|
| Molecular Weight | 356.10 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.10486 |
| Heavy Atoms | 27 |
| Complexity | 595.0 |
Chemical Identifiers
| CAS Number | 1508-89-0 |
|---|---|
| SMILES | CC(=O)OC1=CC2=C(C=C1)C(=C(C(=O)O2)C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | FQQDPAQRLJYOJO-UHFFFAOYSA-N |
Product Overview
Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester (CAS 1508-89-0), with molecular formula C23H16O4 and molecular weight 356.10 g/mol. IUPAC: (2-oxo-3,4-diphenylchromen-7-yl) acetate.
Chemical Property Profile of Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester
Property Insights of Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester
The XLogP value of 4.5 indicates that Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester 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 Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester?
The CAS number of Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester is 1508-89-0.
What is the molecular formula of Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester?
The molecular formula of Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester is C23H16O4.
What is the molecular weight of Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester?
The molecular weight of Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester is 356.10 g/mol.
Where can I buy Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester?
You can request a quote for Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid 3,4-diphenyl-2-oxo-2H-benzopyran-7-yl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.