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Halazone structure
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Halazone

TL;DR: Halazone (CAS 80-13-7) is a chemical compound with molecular formula C7H5Cl2NO4S and molecular weight 268.93164 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-(dichlorosulfamoyl)benzoic acid

Also Known As: halazone, Halazon, Pantocide, Pantocid, Cloritines

CAS Number
80-13-7
Molecular Formula
C7H5Cl2NO4S
Molecular Weight
268.93164 g/mol
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Application Areas

Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (126 patents) Biotechnology (5 patents) Catalysts (10 patents) Coatings & Adhesives (28 patents) Construction Chemicals (1 patents)

Technical Specifications

Molecular FormulaC7H5Cl2NO4S
Molecular Weight268.93164 g/mol
XLogP1.6
Topological Polar Surface Area (TPSA)83.1 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors5
Rotatable Bonds2
Exact Mass268.93164 Da
Heavy Atoms15
Complexity329.0
Melting Point415 °F (NTP, 1992)
Solubilityless than 1 mg/mL at 70 °F (NTP, 1992)
SMILESC1=CC(=CC=C1C(=O)O)S(=O)(=O)N(Cl)Cl
InChIKeyXPDVQPODLRGWPL-UHFFFAOYSA-N

Product Description

Applications: Halazone is used in pharmaceutical synthesis routes and API production, as well as agrochemical development, including crop protection agent synthesis. 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).

Halazone (CAS 80-13-7) is a pharmaceutical intermediate with the molecular formula C7H5Cl2NO4S and a molecular weight of 268.93 g/mol. Key physical properties include a solubility: less than 1 mg/mL at 70 °F (NTP, 1992). Synonyms include halazone and Halazon.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Halazone

XLogP
1.6
TPSA (Topological Polar Surface Area)
83.1
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
2
Heavy Atoms
15
Complexity
329.0
Exact Mass
268.93164
Monoisotopic Mass
268.93164
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Halazone

The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Halazone. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Halazone. Following Lipinski's Rule of Five, Halazone 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 Halazone?

The CAS number of Halazone is 80-13-7.

What is the molecular formula of Halazone?

The molecular formula of Halazone is C7H5Cl2NO4S.

What is the molecular weight of Halazone?

The molecular weight of Halazone is 268.93164 g/mol.

What are the applications of Halazone?

Halazone is used in pharmaceutical synthesis routes and API production, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis...

Where can I buy Halazone?

You can request a quote for Halazone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Halazone?

Yes, CoreyChem provides custom synthesis services for Halazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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