CAS 622-78-6

Benzyl isothiocyanate

Description:

Benzyl isothiocyanate is an organic compound with the molecular formula C9H9NCS. It is characterized by the presence of an isothiocyanate functional group (-N=C=S) attached to a benzyl group. This compound typically appears as a colorless to pale yellow liquid with a pungent odor reminiscent of mustard. It is soluble in organic solvents such as ethanol and ether but has limited solubility in water. Benzyl isothiocyanate is known for its biological activity, exhibiting antimicrobial and antifungal properties, which makes it of interest in food preservation and potential therapeutic applications. Additionally, it is used in the synthesis of various chemical compounds and as a reagent in organic chemistry. Due to its reactive isothiocyanate group, it can participate in nucleophilic reactions, making it valuable in the development of pharmaceuticals and agrochemicals. However, caution is advised when handling this compound, as it can be irritating to the skin and respiratory system.

Formula: C₈H₇NS

InChI: InChI=1S/C8H7NS/c10-7-9-6-8-4-2-1-3-5-8/h1-5H,6H2

InChI key: InChIKey=MDKCFLQDBWCQCV-UHFFFAOYSA-N

SMILES: C(N=C=S)C1=CC=CC=C1

Synonyms:

• (Isothiocyanatomethyl)benzene
• (Isothiocyanatomethyl)benzol
• 1-(Isothiocyanatomethyl)benzene
• Ab 2
• Benzene, (isothiocyanatomethyl)-
• Benzyl Isothiocyanate
• Benzyl mustard oil
• Benzylisothiocyanat
• Isothiocyanate De Benzyle
• Isothiocyanic acid, benzyl ester
• Isotiocianato De Bencilo
• Nsc 118976
• Phenylmethyl isothiocyanate
• Toluene, .alpha.-isothiocyanato-
• Tromacaps
• Tromalyt
• Urogran

Benzyl Isothiocyanate

CAS: 622-78-6

Formula: C₈H₇NS

Purity: >98.0%(GC)

Color and Shape: Colorless to Orenge to Yellow green clear liquid

Molecular weight: 149.21

Ref: 3B-I0224

Benzyl isothiocyanate, 98%

CAS: 622-78-6

Benzyl isothiocyanate is used in a synthesis of 2-phenylpyrimidine-4-thiones from Benzoyl­acetonitrile. Benzyl isothiocyanate has been used in the preparation of S-(N-benzylthiocarbamoyl)-L-glutathione and S-(N-benzylthiocarbamoyl)-L-cysteine. This Thermo Scientific Chemicals brand product was origi

Formula: C₈H₇NS

Purity: 98%

Color and Shape: Liquid, Clear colorless to yellow

Molecular weight: 149.21

Ref: 02-A15008

Benzyl isothiocyanate

CAS: 622-78-6

Formula: C₈H₇NS

Purity: 98%

Color and Shape: Liquid

Molecular weight: 149.2129

Ref: IN-DA0034ID

Benzylisothiocyanate

CAS: 622-78-6

Benzylisothiocyanate

Purity: ≥95%

Color and Shape: Dark Brown Liquid

Molecular weight: 149.21g/mol

Ref: 54-OR3098

Benzyl isothiocyanate

CAS: 622-78-6

Formula: C₆H₅CH₂NCS

Purity: ≥ 98.0%

Color and Shape: Clear, colourless to yellow liquid

Molecular weight: 149.22

Ref: 7W-GL2673

Benzyl isothiocyanate

CAS: 622-78-6

Benzyl isothiocyanate

Purity: ≥98%

Molecular weight: 149.21g/mol

Ref: 54-BUP16721

Benzyl isothiocyanate

CAS: 622-78-6

Formula: C₈H₇NS

Purity: 98%

Color and Shape: Clear Liquid

Molecular weight: 149.21

Ref: 10-F002504

Benzyl isothiocyanate

CAS: 622-78-6

BITC, found in cruciferous veggies, exhibits anticancer, antimicrobial, and immunomodulatory effects.

Formula: C₈H₇NS

Purity: 99.25% - 99.83%

Color and Shape: Clear Yellow Liquid

Molecular weight: 149.21

Ref: TM-T1082

Benzyl Isothiocyanate

Controlled Product

CAS: 622-78-6

Applications A novel medical application of isothiocyanate ester in treating various leukemia, with low toxicity, which includes benzyl isothiocyanate, phenylethyl isothiocyanate, allyl isothiocyanate, sulforaphane, and erucin. Benzyl isothiocyanate (BITC) inhibits the growth of human pancreatic cancer cells by inducing apoptosis.
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Kubinyi, H., et al.: J. Cancer Res. Clin. Oncol., 116, 529 (1990), Sheridan, R., et al.: J. Med. Chem., 50, 3173 (2007), Sahu, R.P., et al.: Carcinogenesis, 30, 1744 (2009),

Formula: C₈H₇NS

Color and Shape: Neat

Molecular weight: 149.21

Ref: TR-B281500