4,4-Dibromo-1-phenylpyrazolidine-3,5-dione
TL;DR: 4,4-Dibromo-1-phenylpyrazolidine-3,5-dione (CAS 132214-59-6) is a chemical compound with molecular formula C9H6Br2N2O2 and molecular weight 331.8796 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,4-dibromo-1-phenylpyrazolidine-3,5-dione
Also Known As: 4,4-dibromo-1-phenylpyrazolidine-3,5-dione, 3,5-Pyrazolidinedione, 4,4-dibromo-1-phenyl-, 1-Phenyl-4,4-dibromopyrazolidine-3,5-dione, 4,4-dibromo-1-phenyl-3,5-pyrazolidinedione, J2.879.888A
Technical Specifications
| Molecular Formula | C9H6Br2N2O2 |
| Molecular Weight | 331.8796 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 331.8796 Da |
| Heavy Atoms | 15 |
| Complexity | 300.0 |
| SMILES | C1=CC=C(C=C1)N2C(=O)C(C(=O)N2)(Br)Br |
| InChIKey | KSEGDINTQMTLAW-UHFFFAOYSA-N |
Chemical Property Profile of 4,4-Dibromo-1-phenylpyrazolidine-3,5-dione
Property Insights of 4,4-Dibromo-1-phenylpyrazolidine-3,5-dione
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4-Dibromo-1-phenylpyrazolidine-3,5-dione. With a topological polar surface area (TPSA) of 49.4 Ų, 4,4-Dibromo-1-phenylpyrazolidine-3,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4-Dibromo-1-phenylpyrazolidine-3,5-dione has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4,4-Dibromo-1-phenylpyrazolidine-3,5-dione?
The CAS number of 4,4-Dibromo-1-phenylpyrazolidine-3,5-dione is 132214-59-6.
What is the molecular formula of 4,4-Dibromo-1-phenylpyrazolidine-3,5-dione?
The molecular formula of 4,4-Dibromo-1-phenylpyrazolidine-3,5-dione is C9H6Br2N2O2.
What is the molecular weight of 4,4-Dibromo-1-phenylpyrazolidine-3,5-dione?
The molecular weight of 4,4-Dibromo-1-phenylpyrazolidine-3,5-dione is 331.8796 g/mol.
Where can I buy 4,4-Dibromo-1-phenylpyrazolidine-3,5-dione?
You can request a quote for 4,4-Dibromo-1-phenylpyrazolidine-3,5-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,4-Dibromo-1-phenylpyrazolidine-3,5-dione?
Yes, CoreyChem provides custom synthesis services for 4,4-Dibromo-1-phenylpyrazolidine-3,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.