CAS 59997-51-2

Pivaloylacetonitrile

Description:

Pivaloylacetonitrile, with the CAS number 59997-51-2, is an organic compound characterized by its structure, which includes a pivaloyl group and a nitrile functional group. It is typically a colorless to pale yellow liquid with a distinctive odor. This compound is known for its role as an intermediate in organic synthesis, particularly in the production of pharmaceuticals and agrochemicals. Pivaloylacetonitrile exhibits moderate polarity due to the presence of the nitrile group, which can participate in various chemical reactions, including nucleophilic additions and condensation reactions. Its boiling point and solubility characteristics make it suitable for use in various organic solvents. Additionally, it is important to handle this compound with care, as it may pose health risks if inhaled or ingested, and appropriate safety measures should be taken during its use in laboratory or industrial settings. Overall, pivaloylacetonitrile is a valuable compound in synthetic organic chemistry due to its reactivity and versatility.

Formula: C₇H₁₁NO

InChI: InChI=1S/C7H11NO/c1-7(2,3)6(9)4-5-8/h4H2,1-3H3

InChI key: InChIKey=MXZMACXOMZKYHJ-UHFFFAOYSA-N

SMILES: C(C(C)(C)C)(CC#N)=O

Synonyms:

• 1-Cyano-3,3-dimethyl-2-butanone
• 4,4-Dimethyl-3-Oxopentanenitrile
• 4,4-Dimethyl-3-oxopentaneitrile
• 4,4-Dimethyl-3-oxovaleronitrile
• Cyanomethyl tert-butyl ketone
• Cyanopinacolone
• Pentanenitrile, 4,4-dimethyl-3-oxo-
• Pivaloyacetonitrile
• Pyvaolylacetonitrile
• Trimethylacetylacetonitrile
• Valeronitrile, 4,4-dimethyl-3-oxo-

Pivaloylacetonitrile

CAS: 59997-51-2

Formula: C₇H₁₁NO

Purity: >98.0%(GC)

Color and Shape: White to Almost white powder to crystal

Molecular weight: 125.17

Ref: 3B-P1112

Trimethylacetylacetonitrile, 99%

CAS: 59997-51-2

Trimethylacetylacetonitrile is a useful intermediate. 4,4-Dimethyl-3-oxopentanenitrile has been used in the preparation of 4,4-dimethyl-3-oxo-2-benzylpentanenitrile, 4,4-dimethyl-3-oxo-2-(4-hydroxybenzyl)pentanenitrile, 4,4-dimethyl-3-oxo-2-(4-methoxybenzyl)pentanenitrile, 4,4-dimethyl-3-oxo-2-(4-

Formula: C₇H₁₁NO

Purity: 99%

Color and Shape: Crystals or powder or crystalline powder, White to cream

Molecular weight: 125.17

Ref: 02-A16309

4,4-Dimethyl-3-oxopentanenitrile

CAS: 59997-51-2

Formula: C₇H₁₁NO

Purity: 97%

Color and Shape: Solid

Molecular weight: 125.1683

Ref: IN-DA003TT5

4,4-Dimethyl-3-oxopentanenitrile

CAS: 59997-51-2

4,4-Dimethyl-3-oxopentanenitrile

Formula: C₇H₁₁NO

Purity: ≥95%

Color and Shape: white to off white crystalline solid

Molecular weight: 125.17g/mol

Ref: 54-OR23696

4,4-Dimethyl-3-oxo-pentanenitrile

CAS: 59997-51-2

Formula: C₇H₁₁NO

Purity: 97%

Color and Shape: Solid

Molecular weight: 125.171

Ref: 10-F021523