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Thiobenzoic acid

CAS 98-91-9C6H5COSHChemical Synthesis

Thiobenzoic acid (CAS 98-91-9) is an organosulfur compound with the linear formula C6H5COSH and a molecular weight of 138.19 g/mol. This compound serves as a valuable building block and reagent in organic synthesis. Its characteristic thiocarbonyl functionality makes it useful for introducing sulfur moieties in various chemical transformations. Thiobenzoic acid is typically supplied at an assay of 90%.

Synonyms
Benzenecarbothioic acidBenzoic acid, thio-
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Thiobenzoic acid (C6H5COSH) — chemical structure, CAS 98-91-9; Chemistry, fine chemical supplied by Tech Serve Solutions
Building BlocksChemical SynthesisOrganic Building BlocksSulfur CompoundsThiocarbonyl Compounds
01 /Applications

Organic Synthesis Reagent

Thiobenzoic acid is employed as a versatile reagent in organic synthesis. It can be used for the preparation of thioesters, thioethers, and other sulfur-containing organic molecules. Its reactivity profile makes it suitable for a range of coupling and functionalization reactions.

Building Block for Heterocycles

This compound acts as a crucial building block in the synthesis of various heterocyclic compounds. The sulfur atom can participate in ring-forming reactions, leading to diverse sulfur-containing heterocycles with potential applications in medicinal chemistry and materials science.

Precursor for Sulfur-Containing Compounds

Thiobenzoic acid serves as a precursor for a variety of specialized sulfur-containing organic compounds. It facilitates the introduction of the benzoylthio group, enabling the synthesis of complex molecules with tailored properties.

02 /Properties
Molecular weight138.19
Linear formulaC6H5COSH
Assay90%
Boiling point122 °C/30 mmHg(lit.)
Density1.174 g/mL at 25 °C(lit.)
Refractive indexn20/D 1.605(lit.)
Storage temperature2-8°C
Melting point15-18 °C(lit.)
03 /Safety & handling
GHS hazard pictogram: Harmful / irritant (GHS07)
Harmful / irritant
Warning

Hazard statements

  • H315Causes skin irritation
  • H319Causes serious eye irritation
  • H335May cause respiratory irritation

Precautionary statements

  • P261Avoid breathing dust, fume, gas or vapours
  • P305IF IN EYES
Protective equipmentEyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Flash point94 °C / 201.2 °F
Transport (UN / ADR)UN 3334
Water hazard class (WGK, DE)3
Hazard codes (EU)Xi
Risk statements (R)36/37/38
Safety statements (S)26-28

Hazard information is provided for guidance. Always consult the product Safety Data Sheet (SDS), available on request, before handling.

04 /Identifiers & registry
CAS number
98-91-9
MDL number
MFCD00004852
PubChem substance
24900083
Beilstein registry
2039640
05 /Quality & supply

Documentation

Every batch ships with a Certificate of Analysis covering assay, identity and purity; the grade is confirmed against your enquiry. Safety Data Sheets and technical data sheets are available on request.

Supply & logistics

Samples for technical evaluation; bulk MOQ by grade and packaging. In-stock material ships in 7–10 working days, worldwide, with full export documentation.

06 /Frequently asked questions

What is Thiobenzoic acid used for?

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Thiobenzoic acid is primarily used as a reagent and building block in organic synthesis, particularly for introducing sulfur-containing functionalities and in the preparation of thioesters and heterocyclic compounds.

What are the CAS number and formula for Thiobenzoic acid?

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The CAS number for Thiobenzoic acid is 98-91-9, and its linear formula is C6H5COSH.

What grade and purity does Tech Serve Solutions supply?

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Tech Serve Solutions supplies Thiobenzoic acid with an assay of 90%. We do not represent this product as USP, BP, or EP grade.

What are the main hazards associated with Thiobenzoic acid?

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Thiobenzoic acid is a warning substance that causes skin irritation (H315), serious eye irritation (H319), and may cause respiratory irritation (H335).

How is Thiobenzoic acid handled and stored?

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Handle Thiobenzoic acid with appropriate personal protective equipment, including eyeshields and gloves. It is recommended to store the chemical at 2-8°C to maintain its stability.

How is Thiobenzoic acid packed, shipped, and exported?

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Thiobenzoic acid is packed and shipped according to relevant transport regulations, including UN 3334 for air transport. TSS offers global export services for this chemical.

How can I request a quote or sample of Thiobenzoic acid?

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To request a quote or sample of Thiobenzoic acid, please contact our sales department through the website or by phone. Our team will be happy to assist you.

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