2-Bromophenyl isothiocyanate
2-Bromophenyl isothiocyanate (CAS: 13037-60-0) is a bromine-substituted aromatic isothiocyanate with the chemical formula BrC6H4NCS and a molecular weight of 214.08 g/mol. This compound serves as a valuable building block in organic synthesis, particularly for the creation of complex heterocyclic structures. Its reactivity makes it suitable for research and development in medicinal chemistry and materials science.
Heterocyclic Synthesis
2-Bromophenyl isothiocyanate is utilized in the synthesis of novel heterocyclic compounds. It has been specifically employed in the preparation of 4-monosubstituted and 4,4-disubstituted 1,4-dihydro-3,1-benzoxazine-2-thiones, showcasing its utility in constructing complex ring systems.
Organic Building Block
As an organic building block, this compound provides a reactive isothiocyanate group attached to a brominated phenyl ring. This functionality allows for diverse chemical transformations, enabling the introduction of sulfur and nitrogen-containing moieties into target molecules.
Research and Development
Its specific chemical structure and reactivity make 2-Bromophenyl isothiocyanate a useful reagent in academic and industrial research laboratories. It aids in exploring new synthetic pathways and developing novel chemical entities for various applications.
| Molecular weight | 214.08 |
|---|---|
| Linear formula | BrC6H4NCS |
| Assay | 98% |
| Boiling point | 257 °C/770 mmHg(lit.) |
| Density | 1.591 g/mL at 25 °C(lit.) |
| Refractive index | n20/D 1.6843(lit.) |
| Application | 2-Bromophenyl isothiocyanate has been used in the synthesis of 4-monosubstituted and 4,4-disubstituted 1,4-dihydro-3,1-benzoxazine-2-thiones1. |
Hazard statements
- H302Harmful if swallowed
- H312Harmful in contact with skin
- H315Causes skin irritation
- H319Causes serious eye irritation
- H332Harmful if inhaled
- H334May cause allergy or asthma symptoms if inhaled
- H335May cause respiratory irritation
Precautionary statements
- P261Avoid breathing dust, fume, gas or vapours
- P280Wear protective gloves, clothing and eye/face protection
- P305IF IN EYES
- P342
| Protective equipment | Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter |
|---|---|
| Flash point | 113 °C / 235.4 °F |
| Transport (UN / ADR) | UN 3334 |
| Water hazard class (WGK, DE) | 3 |
| Hazard codes (EU) | Xn |
| Risk statements (R) | 20/21/22-36/37/38-42 |
| Safety statements (S) | 22-26-36/37-45 |
Hazard information is provided for guidance. Always consult the product Safety Data Sheet (SDS), available on request, before handling.
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.
What is 2-Bromophenyl isothiocyanate used for?
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2-Bromophenyl isothiocyanate is primarily used as an organic building block in chemical synthesis, particularly for the preparation of heterocyclic compounds such as 1,4-dihydro-3,1-benzoxazine-2-thiones.
What is the CAS number and chemical formula for 2-Bromophenyl isothiocyanate?
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The CAS number for 2-Bromophenyl isothiocyanate is 13037-60-0, and its chemical formula is BrC6H4NCS.
What grade and purity does Tech Serve Solutions supply?
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Tech Serve Solutions supplies 2-Bromophenyl isothiocyanate with a minimum assay of 98%. This product is suitable for research and technical applications. TSS does not represent this product as USP, BP, EP, or pharmacopoeia grade.
How should 2-Bromophenyl isothiocyanate be handled safely?
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2-Bromophenyl isothiocyanate is classified as a Danger. It is harmful if swallowed, in contact with skin, or if inhaled, and causes skin and serious eye irritation. It may also cause respiratory irritation and allergic skin reaction. Handle with appropriate personal protective equipment, including eyeshields, face shields, gloves, and respiratory protection, in a well-ventilated area. Refer to the Safety Data Sheet for comprehensive handling instructions.
How is 2-Bromophenyl isothiocyanate packed, shipped, and exported?
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2-Bromophenyl isothiocyanate is carefully packed according to international shipping regulations for hazardous materials. As a global supplier and exporter, Tech Serve Solutions ensures compliant and secure packaging for worldwide distribution.
How can I request a sample or quote for 2-Bromophenyl isothiocyanate?
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To request a sample or a quotation for 2-Bromophenyl isothiocyanate, please visit the Tech Serve Solutions website or contact our sales department directly with your specific requirements.
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