CAS 2131-61-5

4-Nitrophenyl isothiocyanate

Description:

4-Nitrophenyl isothiocyanate is an organic compound characterized by the presence of both a nitro group and an isothiocyanate functional group attached to a phenyl ring. Its molecular formula is C8H6N2O2S, and it features a distinctive yellow crystalline appearance. This compound is known for its reactivity, particularly in nucleophilic substitution reactions, where the isothiocyanate group can react with amines and alcohols to form thioureas and thiocarbamates, respectively. It is often utilized in organic synthesis and as a reagent in various chemical analyses, including the detection of amines and the study of protein interactions. Additionally, 4-nitrophenyl isothiocyanate exhibits moderate toxicity, necessitating careful handling and appropriate safety measures in laboratory settings. Its applications extend to fields such as biochemistry and medicinal chemistry, where it serves as a valuable tool for modifying biomolecules and studying their properties.

Formula: C₇H₄N₂O₂S

InChI: InChI=1S/C7H4N2O2S/c10-9(11)7-3-1-6(2-4-7)8-5-12/h1-4H

InChI key: InChIKey=NXHSSIGRWJENBH-UHFFFAOYSA-N

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

Synonyms:

• 1-(Isothiocyanatomethyl)-4-Nitrobenzene
• 1-Isothiocyanato-4-Nitrobenzene
• 4-Nitrobenzyl thiocyanate
• 4-Nitrophenyl Isothiocyanate
• Benzene, 1-isothiocyanato-4-nitro-
• Isothiocyanic acid, p-nitrophenyl ester
• p-Nitrophenyl isothiocyanate

4-Nitrophenyl Isothiocyanate

CAS: 2131-61-5

Formula: C₇H₄N₂O₂S

Purity: >99.0%(GC)

Color and Shape: Light orange to Yellow to Green powder to crystal

Molecular weight: 180.18

Ref: 3B-N0826

4-Nitrophenyl isothiocyanate, 97%

CAS: 2131-61-5

4-Nitrophenyl isothiocyanate is used as specializing in synthesizing of organic fine chemicals and pharmaceutical intermediates for use in development and production This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label

Formula: C₇H₄N₂O₂S

Purity: 97%

Color and Shape: Cream to yellow, Powder or lumpy solid

Molecular weight: 180.18

Ref: 02-L11042

4-Nitrophenyl isothiocyanate

CAS: 2131-61-5

Formula: C₇H₄N₂O₂S

Purity: 98%

Color and Shape: Solid

Molecular weight: 180.1839

Ref: IN-DA003LW0

4-Nitrophenyl isothiocyanate

CAS: 2131-61-5

4-Nitrophenyl isothiocyanate

Purity: 98%

Color and Shape: Powder

Molecular weight: 180.18g/mol

Ref: 54-OR322064

4-Nitrophenyl isothiocyanate

CAS: 2131-61-5

Formula: C₇H₄N₂O₂S

Purity: 97.0%

Color and Shape: Solid

Molecular weight: 180.18

Ref: 10-F002722