Benzoylacetonitrile
Benzoylacetonitrile (CAS 614-16-4), with the linear formula C₆H₅COCH₂CN and molecular weight 145.16, is a valuable organic building block. This nitrile compound is primarily utilized in chemical synthesis for the preparation of various heterocyclic systems. Its reactivity makes it an important intermediate in the development of novel organic molecules for research and development purposes.
- IUPAC
- β-Oxohydrocinnamonitrile
- Synonyms
- β-Oxohydrocinnamonitrile
Synthesis of Heterocycles
Benzoylacetonitrile serves as a key precursor in the synthesis of diverse heterocyclic compounds, including substituted naphtho[1,8-bc]pyrans and 4H-pyrans. Its structure facilitates cyclization reactions, making it essential for creating complex ring systems.
Preparation of Nitrogen-Containing Compounds
This chemical is employed in the preparation of important nitrogen-containing heterocycles such as 2-pyridones. The nitrile group and active methylene are crucial for its role in these synthetic pathways.
Furan and Carbocyclic Synthesis
Benzoylacetonitrile is a versatile building block used in the synthesis of furan derivatives and carbocyclic structures. Its application expands across various branches of organic synthesis.
| Molecular weight | 145.16 |
|---|---|
| Linear formula | C6H5COCH2CN |
| Assay | 99% |
| Boiling point | 160 °C/10 mmHg(lit.) |
| Application | Benzoylacetonitrile was used in the synthesis of substituted naphtho[1,8-bc]pyrans. It was also used as building block in the preparation of 4H-pyrans1,2,3, 2-pyridones4,5, furans6 and carbocyclics7,8,9. |
| Melting point | 82-83 °C(lit.) |
Hazard statements
- H302Harmful if swallowed
- H312Harmful in contact with skin
- H315Causes skin irritation
- H319Causes serious eye irritation
- H332Harmful 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
| Protective equipment | dust mask type N95 (US), Eyeshields, Gloves |
|---|---|
| Water hazard class (WGK, DE) | 3 |
| Hazard codes (EU) | Xn |
| Risk statements (R) | 20/21/22-36/37/38 |
| Safety statements (S) | 26-36 |
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 Benzoylacetonitrile used for?
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Benzoylacetonitrile is used as a building block in organic synthesis, particularly for the preparation of heterocycles such as naphtho[1,8-bc]pyrans, 4H-pyrans, 2-pyridones, and furans.
What is the CAS number and chemical formula for Benzoylacetonitrile?
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The CAS number for Benzoylacetonitrile is 614-16-4, and its linear formula is C₆H₅COCH₂CN.
What grade and purity does Tech Serve Solutions supply for Benzoylacetonitrile?
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Tech Serve Solutions supplies Benzoylacetonitrile with a purity of 99% (Assay). We do not represent this product as USP, BP, or EP grade.
How should Benzoylacetonitrile be handled safely?
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Benzoylacetonitrile is harmful if swallowed, in contact with skin, or if inhaled, and causes skin and eye irritation and may cause respiratory irritation. Use a dust mask type N95 (US), eyeshields, and gloves. Ensure adequate ventilation and avoid dust formation.
How is Benzoylacetonitrile packed and shipped?
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Benzoylacetonitrile is carefully packed and exported by Tech Serve Solutions to meet international shipping standards for chemicals.
How can I request a quote or sample for Benzoylacetonitrile?
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To request a quote or sample for Benzoylacetonitrile, please contact our sales team through our website or by phone.
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