CAS 3320-86-3

2-Nitrophenyl isocyanate

Description:

2-Nitrophenyl isocyanate is an organic compound characterized by the presence of both a nitro group and an isocyanate functional group attached to a phenyl ring. Its molecular structure features a phenyl ring substituted at the second position with a nitro group (–NO2) and an isocyanate group (–N=C=O). This compound is typically a yellow to brown solid at room temperature and is known for its reactivity, particularly in nucleophilic addition reactions due to the electrophilic nature of the isocyanate group. It is used in various applications, including the synthesis of pharmaceuticals, agrochemicals, and as a reagent in organic chemistry for the preparation of ureas and other derivatives. 2-Nitrophenyl isocyanate is also noted for its potential toxicity and should be handled with care, following appropriate safety protocols to avoid inhalation or skin contact. Its properties make it a valuable intermediate in chemical synthesis, but its reactivity necessitates careful management in laboratory settings.

Formula: C₇H₄N₂O₃

InChI: InChI=1S/C7H4N2O3/c10-5-8-6-3-1-2-4-7(6)9(11)12/h1-4H

InChI key: InChIKey=JRVZITODZAQRQM-UHFFFAOYSA-N

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

Synonyms:

• 1-Isocyanato-2-nitrobenzene
• Ai3-28252
• Benzene, 1-isocyanato-2-nitro-
• Isocyanic acid, o-nitrophenyl ester
• Nsc 5384
• o-Nitrophenyl isocyanate
• 2-Nitrophenyl isocyanate

2-Nitrophenyl isocyanate

CAS: 3320-86-3

Formula: C₇H₄N₂O₃

Purity: 96%

Color and Shape: Solid

Molecular weight: 164.1183

Ref: IN-DA003HSU

2-Nitrophenyl isocyanate

CAS: 3320-86-3

2-Nitrophenyl isocyanate

Purity: 98%

Color and Shape: Yellow Solid

Molecular weight: 164.11826g/mol

Ref: 54-OR11228

1-Isocyanato-2-nitrobenzene

CAS: 3320-86-3

Formula: C₇H₄N₂O₃

Purity: 98%(HPLC);RG

Color and Shape: Solid

Molecular weight: 164.12

Ref: 10-F044445