3,5-Dimethylbenzoylacetonitrile, with the molecular formula C11H11NO, is a white crystalline solid that serves as a crucial raw material in the synthesis of a range of organic compounds. It is a versatile intermediate in organic chemistry, known for its ability to participate in various chemical reactions such as condensation, reduction, and oxidation. Due to its potential health and safety hazards, it is essential to handle 3,5-DIMETHYLBENZOYLACETONITRILE with care.

85692-25-7

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Basic information
1. Product Name: 3,5-DIMETHYLBENZOYLACETONITRILE
2. Synonyms: 3,5-DIMETHYLBENZOYLACETONITRILE;3-(3,5-DIMETHYLPHENYL)-3-OXOPROPIONITRILE;UKRORGSYN-BB BBV-073949
3. CAS NO:85692-25-7
4. Molecular Formula: C₁₁H₁₁NO
5. Molecular Weight: 173.21
6. EINECS: N/A
7. Product Categories: N/A
8. Mol File: 85692-25-7.mol
Chemical Properties
1. Melting Point: N/A
2. Boiling Point: 338.841°C at 760 mmHg
3. Flash Point: 158.725°C
4. Appearance: /
5. Density: 1.06g/cm³
6. Vapor Pressure: 0mmHg at 25°C
7. Refractive Index: 1.53
8. Storage Temp.: N/A
9. Solubility: N/A
10. CAS DataBase Reference: 3,5-DIMETHYLBENZOYLACETONITRILE(CAS DataBase Reference)
11. NIST Chemistry Reference: 3,5-DIMETHYLBENZOYLACETONITRILE(85692-25-7)
12. EPA Substance Registry System: 3,5-DIMETHYLBENZOYLACETONITRILE(85692-25-7)
Safety Data
1. Hazard Codes: N/A
2. Statements: N/A
3. Safety Statements: N/A
4. WGK Germany:
5. RTECS:
6. HazardClass: N/A
7. PackingGroup: N/A
8. Hazardous Substances Data: 85692-25-7(Hazardous Substances Data)

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Uses

Used in Pharmaceutical Industry:
3,5-Dimethylbenzoylacetonitrile is used as a key intermediate in the synthesis of pharmaceuticals for its ability to facilitate the creation of complex organic molecules that can be used in the development of new drugs.
Used in Agrochemical Industry:
In the agrochemical sector, 3,5-dimethylbenzoylacetonitrile is utilized as a precursor in the production of various agrochemicals, contributing to the development of compounds that can enhance crop protection and yield.
Used in Dye Industry:
3,5-Dimethylbenzoylacetonitrile is used as a raw material in the dye industry, where it plays a role in the synthesis of dyes that are used in coloring textiles, plastics, and other materials.
Used in Organic Chemistry Research:
As a versatile intermediate, 3,5-dimethylbenzoylacetonitrile is also used in organic chemistry research for exploring new reaction pathways and developing innovative synthetic methods for organic compounds.

Check Digit Verification of cas no

The CAS Registry Mumber 85692-25-7 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 8,5,6,9 and 2 respectively; the second part has 2 digits, 2 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 85692-25:
(7*8)+(6*5)+(5*6)+(4*9)+(3*2)+(2*2)+(1*5)=167
167 % 10 = 7
So 85692-25-7 is a valid CAS Registry Number.

InChI:InChI=1/C11H11NO/c1-8-5-9(2)7-10(6-8)11(13)3-4-12/h5-7H,3H2,1-2H3

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