CAS 590-42-1

tert-Butyl isothiocyanate

Description:

Tert-Butyl isothiocyanate, with the CAS number 590-42-1, is an organic compound characterized by the presence of an isothiocyanate functional group attached to a tert-butyl group. It is typically a colorless to pale yellow liquid with a pungent odor, reminiscent of mustard or horseradish, due to the presence of the isothiocyanate moiety. This compound is known for its reactivity, particularly in nucleophilic substitution reactions, and can act as a potent electrophile. Tert-Butyl isothiocyanate is soluble in organic solvents but has limited solubility in water. It is utilized in various applications, including as a reagent in organic synthesis and in the study of biological systems, particularly in the context of its potential effects on cellular processes. Safety precautions are necessary when handling this compound, as it can be irritating to the skin, eyes, and respiratory system. Proper storage in a cool, dry place away from incompatible substances is also recommended to maintain its stability and prevent degradation.

Formula: C₅H₉NS

InChI: InChI=1S/C5H9NS/c1-5(2,3)6-4-7/h1-3H3

InChI key: InChIKey=ZFWFRTVIIMTOLY-UHFFFAOYSA-N

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

Synonyms:

• 1,1-Dimethylethyl isothiocyanate
• 2-Isothiocyanato-2-Methyl-Propan
• 2-Isothiocyanato-2-methylpropane
• Isothiocyanic acid, tert-butyl ester
• Propane, 2-isothiocyanato-2-methyl-
• T-Butyl-Isothiocyanate
• tert-Butyl isothiocyanate

tert-Butyl isothiocyanate, 97%

CAS: 590-42-1

tert-Butyl isothiocyanate is a tool for the modification of the pore sizes on the top layer of heterostructured surface mounted metal-organic frameworks. This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information m

Formula: (CH₃)₃CNCS

Purity: 97%

Color and Shape: Clear colorless to yellow, Liquid

Molecular weight: 115.2

Ref: 02-L02668

2-isothiocyanato-2-methylpropane

CAS: 590-42-1

Formula: C₅H₉NS

Purity: 98%

Color and Shape: Liquid

Molecular weight: 115.1967

Ref: IN-DA0035N6

tert-Butyl isothiocyanate

CAS: 590-42-1

tert-Butyl isothiocyanate

Purity: 98%

Color and Shape: Colourless Liquid

Molecular weight: 115.20g/mol

Ref: 54-OR322172

tert-Butyl isothiocyanate

CAS: 590-42-1

Formula: C₅H₉NS

Purity: 97.0%

Color and Shape: Liquid, Clear

Molecular weight: 115.19

Ref: 10-F008754