CAS 591-82-2

Isobutyl isothiocyanate

Description:

Isobutyl isothiocyanate, with the CAS number 591-82-2, is an organic compound characterized by its isothiocyanate functional group attached to an isobutyl chain. It is a colorless to pale yellow liquid with a pungent odor, reminiscent of mustard or horseradish, which is typical of isothiocyanates. This compound is known for its potential biological activity, including antimicrobial and anticancer properties, making it of interest in both food science and medicinal chemistry. Isobutyl isothiocyanate is soluble in organic solvents but has limited solubility in water. It is relatively stable under normal conditions but can undergo hydrolysis in the presence of moisture, leading to the formation of thiourea derivatives. Due to its reactivity, it can participate in various chemical reactions, including nucleophilic substitutions. Safety precautions are necessary when handling this compound, as it can be irritating to the skin, eyes, and respiratory system. Overall, isobutyl isothiocyanate serves as a valuable compound in research and potential applications in agriculture and pharmaceuticals.

Formula: C₅H₉NS

InChI: InChI=1/C5H9NS/c1-5(2)3-6-4-7/h5H,3H2,1-2H3

InChI key: InChIKey=NSDDRJXKROCWRZ-UHFFFAOYSA-N

SMILES: C(C(C)C)N=C=S

Synonyms:

• 1-Isothiocyanato-2-methylpropane
• 2-Methyl-1-propyl isothiocyanate
• 2-Methylpropyl isothiocyanate
• Brn 1740371
• Einecs 209-733-2
• Isothiocyanic acid, isobutyl ester
• Propane, 1-isothiocyanato-2-methyl-
• i-Butyl isothiocyanate
• Isobutyl isothiocyanate
• 4-04-00-00653 (Beilstein Handbook Reference)
• isobutyl mustard oil
• Isobutylisothiocyanate,97%
• Isothiocyanic acid isobutyl est
• 1-isothiocyanato-2-methyl-propan
• 1-ISOTHIOCYANATO-2-METHYL-PROPANE
• i-butylisothiocyanate

Isobutyl Isothiocyanate

CAS: 591-82-2

Formula: C₅H₉NS

Purity: >97.0%(GC)

Color and Shape: Colorless to Light yellow to Light orange clear liquid

Molecular weight: 115.19

Ref: 3B-I0186

Isobutyl isothiocyanate, 97%

CAS: 591-82-2

It is isothiocyanate compound used for proteomics research. This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has

Formula: C₅H₉NS

Purity: 97%

Color and Shape: Clear colorless, Liquid

Molecular weight: 115.19

Ref: 02-A18932

1-isothiocyanato-2-methylpropane

CAS: 591-82-2

Formula: C₅H₉NS

Purity: 98%

Color and Shape: Liquid

Molecular weight: 115.1967

Ref: IN-DA003R2R

Isobutyl Isothiocyanate

CAS: 591-82-2

Formula: C₅H₉NS

Molecular weight: 115.19

Ref: 7W-GX0704

Isobutyl isothiocyanate

CAS: 591-82-2

Isobutyl isothiocyanate

Purity: 97%

Color and Shape: Yellow Liquid

Molecular weight: 115.20g/mol

Ref: 54-OR28903

Isobutyl isothiocyanate

CAS: 591-82-2

Formula: C₅H₉NS

Purity: 98.0%

Color and Shape: Liquid, Clear colourless - Pale yellow liquid

Molecular weight: 115.19

Ref: 10-F008985