Pinocembrin diacetate
TL;DR: Pinocembrin diacetate (CAS 163016-93-1) is a chemical compound with molecular formula C19H16O6 and molecular weight 340.0947 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5-acetyloxy-4-oxo-2-phenyl-2,3-dihydrochromen-7-yl) acetate
Also Known As: Pinocembrin diacetate, ethane,N-ethylaniline, Pinocembrin, diacetate, Pinocembrin diacetic acid, 4-Oxo-2-phenylchroman-5,7-diyl diacetate
Technical Specifications
| Molecular Formula | C19H16O6 |
| Molecular Weight | 340.0947 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.0947 Da |
| Heavy Atoms | 25 |
| Complexity | 524.0 |
| SMILES | CC(=O)OC1=CC2=C(C(=O)CC(O2)C3=CC=CC=C3)C(=C1)OC(=O)C |
| InChIKey | YZOMNXCYSIYMOX-UHFFFAOYSA-N |
Chemical Property Profile of Pinocembrin diacetate
Property Insights of Pinocembrin diacetate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pinocembrin diacetate. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Pinocembrin diacetate. Following Lipinski's Rule of Five, Pinocembrin diacetate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Pinocembrin diacetate?
The CAS number of Pinocembrin diacetate is 163016-93-1.
What is the molecular formula of Pinocembrin diacetate?
The molecular formula of Pinocembrin diacetate is C19H16O6.
What is the molecular weight of Pinocembrin diacetate?
The molecular weight of Pinocembrin diacetate is 340.0947 g/mol.
Where can I buy Pinocembrin diacetate?
You can request a quote for Pinocembrin diacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pinocembrin diacetate?
Yes, CoreyChem provides custom synthesis services for Pinocembrin diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.