1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone
TL;DR: 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone (CAS 84-57-1) is a chemical compound with molecular formula C10H8Cl2N2O4S and molecular weight 321.9582 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,5-dichloro-4-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonic acid
Also Known As: 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone, Dichlorsulfofenyl-methylpyrazolon, dichlorosulfophenyl-3-methylpyrazolone, 2,5-Dichloro-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzenesulfonic acid, Dichlorsulfofenyl-methylpyrazolon [Czech]
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H8Cl2N2O4S |
| Molecular Weight | 321.9582 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 95.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 321.9582 Da |
| Heavy Atoms | 19 |
| Complexity | 516.0 |
| SMILES | CC1=NN(C(=O)C1)C2=CC(=C(C=C2Cl)S(=O)(=O)O)Cl |
| InChIKey | KCEIVWKDBLAQKL-UHFFFAOYSA-N |
Product Description
Applications: 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone is used in coating, adhesive, and surface treatment formulations, as well as dye and pigment synthesis and coloration chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A coating and adhesive raw material supplied by CoreyChem, 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone (CAS 84-57-1) has the molecular formula C10H8Cl2N2O4S and a molecular weight of 321.96 g/mol. Synonyms include 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone and Dichlorsulfofenyl-methylpyrazolon.
Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone
Property Insights of 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone. The TPSA of 95.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone. Following Lipinski's Rule of Five, 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone has 1 hydrogen bond donor(s) and 5 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-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone?
The CAS number of 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone is 84-57-1.
What is the molecular formula of 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone?
The molecular formula of 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone is C10H8Cl2N2O4S.
What is the molecular weight of 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone?
The molecular weight of 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone is 321.9582 g/mol.
What are the applications of 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone?
1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone is used in coating, adhesive, and surface treatment formulations, as well as dye and pigment synthesis and coloration chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog...
Where can I buy 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone?
You can request a quote for 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone?
Yes, CoreyChem provides custom synthesis services for 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.