CAS 2131-64-8

4-Dimethylaminophenyl isothiocyanate

Description:

4-Dimethylaminophenyl isothiocyanate, with the CAS number 2131-64-8, is an organic compound characterized by the presence of an isothiocyanate functional group attached to a dimethylaminophenyl moiety. This compound typically appears as a yellow to brown solid and is known for its strong odor, reminiscent of mustard oil, due to the isothiocyanate group. It is soluble in organic solvents such as ethanol and acetone but has limited solubility in water. 4-Dimethylaminophenyl isothiocyanate is primarily used in organic synthesis and as a reagent in various chemical reactions, including the synthesis of thioureas and other nitrogen-containing compounds. It exhibits biological activity and has been studied for its potential applications in medicinal chemistry. However, it is important to handle this compound with care, as it can be toxic and irritant, necessitating appropriate safety measures during use. Overall, its unique chemical structure and reactivity make it a valuable compound in both research and industrial applications.

Formula: C₉H₁₀N₂S

InChI: InChI=1S/C9H10N2S/c1-11(2)9-5-3-8(4-6-9)10-7-12/h3-6H,1-2H3

InChI key: InChIKey=HRDJPEMAGYHSJR-UHFFFAOYSA-N

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

Synonyms:

• (4-Isothiocyanatophenyl)dimethylamine
• 4-(Dimethylamino)phenyl isothiocyanate
• 4-(N,N-Dimethylamino)phenyl isothiocyanate
• 4-Isothiocyanato-N,N-dimethylaniline
• 4-Isothiocyanato-N,N-dimethylbenzenamine
• Aniline, p-isothiocyanato-N,N-dimethyl-
• Benzenamine, 4-isothiocyanato-N,N-dimethyl-
• Benzenamine, 4-isothiocyanato-N,N-dimethyl- (9CI)
• Brn 0388270
• Isothiocyanic acid, p-(dimethylamino)phenyl ester
• Isothiocyanic acid, p-dimethylaminophenyl ester
• Nsc 196179
• Tl 1106
• p-(Dimethylamino)phenyl isothiocyanate
• p-(N-Dimethylamino)phenyl isothiocyanate
• p-Isothiocyanato-N,N-dimethylaniline
• 4-13-00-00173 (Beilstein Handbook Reference)
• p-(N,N-Dimethylamino)phenyl isothiocyanate
• tl1106
• Phenylisothiocyanate, 4-dimethylamino
• (4-ISOTHIOCYANATO-PHENYL)-DIMETHYL-AMINE

4-Dimethylaminophenyl isothiocyanate, 97%

CAS: 2131-64-8

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: C₉H₁₀N₂S

Purity: 97%

Color and Shape: Pale cream to cream to yellow to green, Crystals or powder or crystalline powder or lumps or fused solid

Molecular weight: 178.25

Ref: 02-L09011

4-Isothiocyanato-N,N-dimethylbenzenamine

CAS: 2131-64-8

Formula: C₉H₁₀N₂S

Purity: 99%

Molecular weight: 178.2541

Ref: IN-DA003K7U

4-(Dimethylamino)phenyl isothiocyanate

CAS: 2131-64-8

4-(Dimethylamino)phenyl isothiocyanate

Purity: 95%

Color and Shape: Cream Solid

Molecular weight: 178.25g/mol

Ref: 54-OR0411

4-(N,N-Dimethylamino)phenyl isothiocyanate

CAS: 2131-64-8

Formula: C₉H₁₀N₂S

Purity: 97.0%

Color and Shape: Solid

Molecular weight: 178.25

Ref: 10-F005974