Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl-
TL;DR: Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl- (CAS 126266-77-1) is a chemical compound with molecular formula C15H12O3 and molecular weight 240.07864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(1,3-benzodioxol-5-yl)-2-phenylethanone
Also Known As: Benzyl piperonyl ketone, TimTec1_005217, Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl-, 1-(1,3-benzodioxol-5-yl)-2-phenylethanone, 1-(2H-1,3-benzodioxol-5-yl)-2-phenylethan-1-one
Technical Specifications
| Molecular Formula | C15H12O3 |
| Molecular Weight | 240.07864 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.07864 Da |
| Heavy Atoms | 18 |
| Complexity | 296.0 |
| SMILES | C1OC2=C(O1)C=C(C=C2)C(=O)CC3=CC=CC=C3 |
| InChIKey | GMPAXGVXZYFWRF-UHFFFAOYSA-N |
Chemical Property Profile of Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl-
Property Insights of Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl-. With a topological polar surface area (TPSA) of 35.5 Ų, Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl-?
The CAS number of Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl- is 126266-77-1.
What is the molecular formula of Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl-?
The molecular formula of Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl- is C15H12O3.
What is the molecular weight of Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl-?
The molecular weight of Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl- is 240.07864 g/mol.
Where can I buy Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl-?
You can request a quote for Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl-?
Yes, CoreyChem provides custom synthesis services for Ethanone, 1-(1,3-benzodioxol-5-yl)-2-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.