CAS 2131-55-7

4-Chlorophenyl isothiocyanate

Description:

4-Chlorophenyl isothiocyanate is an organic compound characterized by the presence of both a chlorophenyl group and an isothiocyanate functional group. It typically appears as a yellow to brownish liquid or solid, depending on its purity and conditions. This compound is known for its pungent odor and is soluble in organic solvents such as acetone and ether, but has limited solubility in water. It is primarily used in organic synthesis, particularly in the preparation of various pharmaceuticals and agrochemicals. The isothiocyanate group is reactive, allowing for nucleophilic substitution reactions, which makes it valuable in the synthesis of thioureas and other derivatives. Additionally, 4-Chlorophenyl isothiocyanate exhibits biological activity, including potential antimicrobial and anticancer properties, making it of interest in medicinal chemistry. However, it should be handled with care due to its potential toxicity and irritant properties. Proper safety measures, including the use of personal protective equipment, are essential when working with this compound.

Formula: C₇H₄ClNS

InChI: InChI=1S/C7H4ClNS/c8-6-1-3-7(4-2-6)9-5-10/h1-4H

InChI key: InChIKey=MZZVFXMTZTVUFO-UHFFFAOYSA-N

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

Synonyms:

• 1-Chlor-4-isothiocyanatobenzol
• 1-Chloro-4-Isothiocyanatobenzene
• 1-Cloro-4-Isotiocianatobenceno
• 4-Chloro-phenylisothiocyanate
• Benzene, 1-chloro-4-isothiocyanato-
• Isothiocyanic Acid 4-Chlorophenyl Ester
• Isothiocyanic acid, p-chlorophenyl ester
• Nsc 20213
• Sch 20350
• p-Chlorophenyl isothiocyanate
• 4-Chlorophenyl isothiocyanate

4-Chlorophenyl Isothiocyanate

CAS: 2131-55-7

Formula: C₇H₄ClNS

Purity: >98.0%(GC)

Color and Shape: White to Light yellow powder to crystal

Molecular weight: 169.63

Ref: 3B-I0167

4-Chlorophenyl isothiocyanate, 98%

CAS: 2131-55-7

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 not changed as a part of the brand transition to Thermo Sci

Formula: C₇H₄ClNS

Purity: 98%

Color and Shape: White to cream to pale yellow, Crystals or powder or crystalline powder or fused solid

Molecular weight: 169.63

Ref: 02-A12693

4-Chlorophenyl isothiocyanate

CAS: 2131-55-7

Formula: C₇H₄ClNS

Purity: 97%

Color and Shape: Solid

Molecular weight: 169.6314

Ref: IN-DA003L7X

4-Chlorophenyl isothiocyanate

CAS: 2131-55-7

4-Chlorophenyl isothiocyanate

Formula: C₇H₄ClNS

Purity: 98%

Color and Shape: white to off-white crystalline solid

Molecular weight: 169.63136g/mol

Ref: 54-OR30198

4-Chlorophenyl isothiocyanate

CAS: 2131-55-7

Formula: C₇H₄ClNS

Purity: 97%

Color and Shape: Solid, Beige solid

Molecular weight: 169.63

Ref: 10-F008775