1-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone
TL;DR: 1-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone (CAS 166816-11-1) is a chemical compound with molecular formula C10H8Cl2O3 and molecular weight 245.98505 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(6,7-dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)ethanone
Also Known As: 1-(6,7-dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone, dichlorodihydrobenzodioxinylethanone, 1-(6,7-dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)ethan-1-one, 1-(6,7-dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)ethanone, 1-(6,7-dichloro-2,3-dihydrobenzo[b][1,4]dioxin-5-yl)ethan-1-one
Technical Specifications
| Molecular Formula | C10H8Cl2O3 |
| Molecular Weight | 245.98505 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 245.98505 Da |
| Heavy Atoms | 15 |
| Complexity | 259.0 |
| SMILES | CC(=O)C1=C2C(=CC(=C1Cl)Cl)OCCO2 |
| InChIKey | IILYXHAHYKTHBH-UHFFFAOYSA-N |
Chemical Property Profile of 1-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone
Property Insights of 1-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone. With a topological polar surface area (TPSA) of 35.5 Ų, 1-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-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-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone?
The CAS number of 1-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone is 166816-11-1.
What is the molecular formula of 1-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone?
The molecular formula of 1-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone is C10H8Cl2O3.
What is the molecular weight of 1-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone?
The molecular weight of 1-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone is 245.98505 g/mol.
Where can I buy 1-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone?
You can request a quote for 1-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone?
Yes, CoreyChem provides custom synthesis services for 1-(6,7-Dichloro-2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.