Zinc;2-(benzenesulfonamido)benzoate;hydroxide

C13H11NO5SZn

zinc;2-(benzenesulfonamido)benzoate;hydroxide

CAS113036-91-2
GHS07 Gefahrensymbol: Gesundheitsschädlich/Reizend – Ausrufezeichen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
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Identification

CAS Number
113036-91-2
EC Number
403-750-0
UN Number
3077
Index Number
030-008-00-X
PubChem CID
165355270

Physical-chemical properties

Molecular Formula
C13H11NO5SZn
Molar Mass
358.70 g/mol
IUPAC Name
zinc;2-(benzenesulfonamido)benzoate;hydroxide

Chemical Identifiers

InChI
InChI=1S/C13H11NO4S.H2O.Zn/c15-13(16)11-8-4-5-9-12(11)14-19(17,18)10-6-2-1-3-7-10;;/h1-9,14H,(H,15,16);1H2;/q;;+2/p-2
InChI Key
TVHGSBXSBKMSER-UHFFFAOYSA-L

Overview

Zinc;2-(benzenesulfonamido)benzoate;hydroxide (CAS 113036-91-2) is an organozinc compound with sulfonamide functionality and moderate toxicity properties. This specialized organometallic compound represents a unique combination of zinc coordination chemistry with sulfonamide and benzoate moieties. The molecular structure features a central zinc atom coordinated with a 2-(benzenesulfonamido)benzoate ligand and hydroxide, creating a complex with distinctive chemical properties. With a molecular weight of 358.7 g/mol and the formula C13H11NO5SZn, this compound belongs to the family of zinc-based organometallic substances used in various industrial applications. The compound exhibits moderate acute toxicity (Acute Tox. 4) and presents chronic aquatic hazards (Aquatic Chronic 2), requiring careful handling protocols. Its GHS07 and GHS09 pictograms indicate both health and environmental concerns, necessitating appropriate safety measures during storage, handling, and transportation. The ADR Class 9 classification identifies it as a miscellaneous dangerous substance for shipping purposes. Key applications include use as a catalyst in organic synthesis reactions, particularly where zinc coordination is beneficial for reaction selectivity and efficiency. The compound also finds application in specialty coatings formulations where its organozinc properties contribute to corrosion resistance and adhesion characteristics. In pharmaceutical intermediates production, its sulfonamide functionality makes it valuable for synthesizing bioactive compounds. This compound shares structural similarities with other organometallic complexes such as benzyl(tributyl)azanium;4-hydroxynaphthalene-1-sulfonate, though it offers distinct reactivity profiles due to its zinc center and specific ligand environment. OYSI maintains reliable supply chains for this specialized organozinc compound, ensuring consistent availability for European industrial customers requiring high-quality chemical intermediates.

Safety & Classification

Warning
Classification:

Acute Tox. 4 *; Aquatic Chronic 2

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H332

Harmful if inhaled.

H411

Toxic to aquatic life with long lasting effects.

Classification according to CLP Regulation (EC) No 1272/2008. The complete list of hazard and precautionary statements can be found in the Safety Data Sheet (SDS).

First Aid Measures

Inhalation

Harmful

Measures if vapours or dust are inhaled

First Aid Actions

  • +P304IF INHALED:
  • +P340Remove person to fresh air and keep comfortable for breathing.
  • +P311Call a POISON CENTER/doctor.

Related hazard statements:

General Measures

Emergency 112 | Poison Control: +49 30 19240 (DE), +33 1 45 42 59 59 (FR), +31 30 274 88 88 (NL)

First aid measures are based on CLP classification and associated P-statements. They do not replace the Safety Data Sheet (SDS). In case of emergency, always consult the full SDS and a physician.

Transport (ADR)

UN Number3077
ADR Class9
Packing GroupIII
Tunnel Code-
Proper Shipping NameHydroxo(2-(benzensulfonamido)-benzoato)-zink(II)
Marine PollutantNo

Frequently Asked Questions

What is zinc;2-(benzenesulfonamido)benzoate;hydroxide?

Zinc;2-(benzenesulfonamido)benzoate;hydroxide is an organometallic compound with the molecular formula C13H11NO5SZn and CAS number 113036-91-2. This zinc-based complex combines a benzenesulfonamido group with a benzoate moiety and hydroxide, resulting in a compound with a molecular weight of 358.7 g/mol. It is classified as moderately hazardous with acute toxicity class 4 and chronic aquatic toxicity class 2, requiring careful handling in industrial applications.

What are the physicochemical properties of zinc;2-(benzenesulfonamido)benzoate;hydroxide?

Zinc;2-(benzenesulfonamido)benzoate;hydroxide is a solid organometallic compound at room temperature with a molecular weight of 358.7 g/mol. As a zinc complex containing both organic and inorganic components, it likely exhibits limited water solubility due to its hybrid structure. The presence of the benzenesulfonamido and benzoate groups suggests it may have moderate solubility in organic solvents. Specific physical properties such as melting point, color, and exact solubility parameters would require detailed characterization studies.

What is zinc;2-(benzenesulfonamido)benzoate;hydroxide used for?

Zinc;2-(benzenesulfonamido)benzoate;hydroxide is typically used as a specialty chemical in pharmaceutical intermediates, advanced materials synthesis, or as a catalyst in specific organic reactions. The combination of zinc with sulfonamide and benzoate functionalities suggests potential applications in medicinal chemistry research, polymer stabilization, or as an antimicrobial agent. Its specific structure makes it valuable for specialized industrial processes requiring precise chemical properties and controlled reactivity in professional laboratory and manufacturing environments.

How to handle zinc;2-(benzenesulfonamido)benzoate;hydroxide safely?

Zinc;2-(benzenesulfonamido)benzoate;hydroxide requires careful handling due to its Acute Tox. 4 classification and aquatic toxicity. Wear appropriate personal protective equipment including safety goggles, protective gloves, and lab coats when handling this compound. Work in well-ventilated areas or under fume hoods to avoid inhalation. Prevent direct skin and eye contact, and avoid release to the environment due to its aquatic chronic toxicity. Follow standard laboratory safety protocols and ensure proper training before use.

How to store zinc;2-(benzenesulfonamido)benzoate;hydroxide correctly?

Zinc;2-(benzenesulfonamido)benzoate;hydroxide should be stored in tightly sealed containers in a cool, dry place away from direct sunlight and moisture. Keep containers properly labeled and store in designated chemical storage areas with appropriate ventilation. Due to its aquatic toxicity, ensure storage areas have containment measures to prevent environmental release. Store away from incompatible materials and maintain storage temperatures as specified by the supplier to preserve chemical stability and prevent degradation.

What to do in case of contact with zinc;2-(benzenesulfonamido)benzoate;hydroxide?

Skin contact with zinc;2-(benzenesulfonamido)benzoate;hydroxide requires immediate removal of contaminated clothing and thorough washing with soap and water for at least 15 minutes. In case of eye contact, flush immediately with clean water for 15-20 minutes and seek medical attention. If inhaled, move to fresh air immediately. If ingested, do not induce vomiting and seek immediate medical attention. Always consult the safety data sheet for specific first aid measures and contact emergency services if symptoms persist.

How to dispose of zinc;2-(benzenesulfonamido)benzoate;hydroxide appropriately?

Zinc;2-(benzenesulfonamido)benzoate;hydroxide must be disposed of as hazardous chemical waste through authorized waste management companies due to its toxicity classification. Never dispose of this compound in regular waste streams or pour down drains due to its aquatic chronic toxicity. Collect waste in appropriate containers, properly label them, and arrange collection by licensed hazardous waste disposal services. Follow local and European waste regulations (EU Waste Framework Directive) and maintain proper documentation for waste disposal tracking.

How to transport zinc;2-(benzenesulfonamido)benzoate;hydroxide?

Zinc;2-(benzenesulfonamido)benzoate;hydroxide is classified as ADR Class 9 (Miscellaneous dangerous substances), Packing Group III for transportation purposes. This classification requires specific packaging, labeling, and documentation according to European ADR regulations. Use UN-approved packaging materials and ensure proper hazard labels are affixed. Transport should be conducted by carriers licensed for hazardous materials, with appropriate shipping papers and emergency response information. Follow ADR requirements for loading, segregation, and vehicle specifications.

Is zinc;2-(benzenesulfonamido)benzoate;hydroxide subject to specific regulations?

Zinc;2-(benzenesulfonamido)benzoate;hydroxide is subject to European REACH regulation for chemical registration and safety assessment, though it is not currently listed as a Substance of Very High Concern (SVHC). It falls under CLP regulation for classification, labeling, and packaging requirements due to its hazard classification. Companies must comply with safety data sheet requirements, risk assessment obligations, and proper hazard communication. Additional sector-specific regulations may apply depending on the intended use and application.

Where to buy zinc;2-(benzenesulfonamido)benzoate;hydroxide in Europe?

Zinc;2-(benzenesulfonamido)benzoate;hydroxide is available through OYSI, a specialized European distributor of technical chemicals and pharmaceutical intermediates. OYSI provides high-quality chemical products with proper documentation, safety data sheets, and regulatory compliance support throughout Europe. As a professional chemical supplier, OYSI ensures proper handling, packaging, and delivery of specialty compounds like this zinc complex to research institutions, pharmaceutical companies, and industrial customers requiring reliable chemical sourcing and technical support.

Data Sources

Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.