4-Chloro-3-nitrobenzonitrile(CAS: 939-80-0)

CAS Number
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Basic Information
Molecular Formula
C7H3ClN2O2
Molecular Weight
182.56 g/mol
Physical Properties
Melting Point
98.0 to 102.0 deg-C
Boiling Point
284.8 °C at 760 mmHg
Density
1.6133 (rough estimate)
Flash Point
126℃
Chemical Identifiers
SMILES
C1=CC(=C(C=C1C#N)[N+](=O)[O-])Cl
InChIKey
XBLPHYSLHRGMNW-UHFFFAOYSA-N
Database References
MDL Number
MFCD00016987
Beilstein Registry Number
1639111
FAQ
4-Chloro-3-nitrobenzonitrile (CAS: 939-80-0) is an aromatic organic compound with the chemical formula C7H4ClNO2. It features a benzene ring substituted with a nitro group at the 3-position, a chloro group at the 4-position, and a nitrile group at the 1-position. This compound is typically a solid with moderate solubility in organic solvents and exhibits strong polarity due to its nitro and nitrile functionalities.
4-Chloro-3-nitrobenzonitrile (CAS: 939-80-0) is primarily used as an intermediate in the synthesis of pharmaceuticals, dyes, and pesticides. Its versatile functional groups make it valuable in chemical research for developing new compounds. It is also employed in industrial processes involving organic chemistry, though specific applications depend on its reactivity and derivatization potential.
4-Chloro-3-nitrobenzonitrile (CAS: 939-80-0) requires careful handling due to its potential toxicity. Inhalation, skin contact, or ingestion may cause irritation or harm. Safety measures include using protective gloves, goggles, and ventilation. It is classified as a hazardous substance under safety standards, and proper storage is essential to minimize risks during handling and use.
4-Chloro-3-nitrobenzonitrile (CAS: 939-80-0) should be stored in a sealed, airtight container in a cool, dry place away from light. It is stable under normal conditions but sensitive to moisture and heat. Storage precautions include maintaining temperatures below 25°C, avoiding exposure to humidity, and keeping it in a well-ventilated area to ensure safety and longevity.
Safety Notice
Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.
Always follow proper handling procedures
Contact Information
Contact Person
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