1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone
TL;DR: 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone (CAS 1011-48-9) is a chemical compound with molecular formula C10H10O3 and molecular weight 178.06299 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2,3-dihydro-1,4-benzodioxin-3-yl)ethanone
Also Known As: 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone, melibiose, 2-acetylbenzodioxane, 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethan-1-one, 1-(2,3-dihydro-1,4-benzodioxin-3-yl)ethanone
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H10O3 |
| Molecular Weight | 178.06299 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 178.06299 Da |
| Heavy Atoms | 13 |
| Complexity | 202.0 |
| SMILES | CC(=O)C1COC2=CC=CC=C2O1 |
| InChIKey | KVCWAZWJLMNADA-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone
Property Insights of 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone. With a topological polar surface area (TPSA) of 35.5 Ų, 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone 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 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone?
The CAS number of 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone is 1011-48-9.
What is the molecular formula of 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone?
The molecular formula of 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone is C10H10O3.
What is the molecular weight of 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone?
The molecular weight of 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone is 178.06299 g/mol.
Where can I buy 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone?
You can request a quote for 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone?
Yes, CoreyChem provides custom synthesis services for 1-(2,3-Dihydro-1,4-benzodioxin-2-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.