3-acetyl-2H-phthalazine-1,4-dione
TL;DR: 3-acetyl-2H-phthalazine-1,4-dione (CAS 15371-04-7) is a chemical compound with molecular formula C10H8N2O3 and molecular weight 204.0535 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-acetyl-2H-phthalazine-1,4-dione
Also Known As: 3-acetyl-2H-phthalazine-1,4-dione, 2-Acetyl-2,3-dihydrophthalazine-1,4-dione
Technical Specifications
| Molecular Formula | C10H8N2O3 |
| Molecular Weight | 204.0535 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 66.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 204.0535 Da |
| Heavy Atoms | 15 |
| Complexity | 327.0 |
| SMILES | CC(=O)N1C(=O)C2=CC=CC=C2C(=O)N1 |
| InChIKey | HXIIVVYRFABCHX-UHFFFAOYSA-N |
Chemical Property Profile of 3-acetyl-2H-phthalazine-1,4-dione
Property Insights of 3-acetyl-2H-phthalazine-1,4-dione
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-acetyl-2H-phthalazine-1,4-dione. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-acetyl-2H-phthalazine-1,4-dione. Following Lipinski's Rule of Five, 3-acetyl-2H-phthalazine-1,4-dione has 1 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 3-acetyl-2H-phthalazine-1,4-dione?
The CAS number of 3-acetyl-2H-phthalazine-1,4-dione is 15371-04-7.
What is the molecular formula of 3-acetyl-2H-phthalazine-1,4-dione?
The molecular formula of 3-acetyl-2H-phthalazine-1,4-dione is C10H8N2O3.
What is the molecular weight of 3-acetyl-2H-phthalazine-1,4-dione?
The molecular weight of 3-acetyl-2H-phthalazine-1,4-dione is 204.0535 g/mol.
Where can I buy 3-acetyl-2H-phthalazine-1,4-dione?
You can request a quote for 3-acetyl-2H-phthalazine-1,4-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-acetyl-2H-phthalazine-1,4-dione?
Yes, CoreyChem provides custom synthesis services for 3-acetyl-2H-phthalazine-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.