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2-Nitrobenzylcyanide(CAS: 610-66-2)

2-Nitrobenzylcyanide
CAS Number

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Basic Information

Molecular Formula
C8H6N2O2
Molecular Weight
17.03 g/mol
Physical State
Yellow to Brown Solid

Physical Properties

Melting Point
82.0 to 86.0 deg-C
Boiling Point
178°C/12mmHg(lit.)
Density
1.3264 (rough estimate)
Flash Point
138℃
Water Solubility
<0.01 g/100 mL at 20 ºC

Chemical Identifiers

SMILES
C1=CC=C(C(=C1)CC#N)[N+](=O)[O-]
InChIKey
QGZKDVFQNNGYKY-UHFFFAOYSA-N

Database References

MDL Number
MFCD00007183
Beilstein Registry Number
1869400

FAQ

2-Nitrobenzylcyanide (CAS: 610-66-2) is a crystalline compound with a molecular weight of approximately 197.08 g/mol. It has a low solubility in water but is more soluble in organic solvents like dichloromethane and acetone. Chemically, it is highly reactive, capable of undergoing nitration and reduction reactions. It is often used in organic synthesis for its reactivity and specific functional groups.
2-Nitrobenzylcyanide (CAS: 610-66-2) is typically synthesized via the nitration of benzylcyanide followed by the introduction of a nitro group. Common methods include nitration with fuming nitric acid or concentrated nitric acid in the presence of sulfuric acid as a catalyst. The reaction is usually conducted at low temperatures to improve selectivity and yield.
2-Nitrobenzylcyanide (CAS: 610-66-2) finds applications in various industries. It is primarily used in pharmaceuticals for the synthesis of certain drugs, in polymers for functionalizing materials, and in sensors for detection of specific analytes. Additionally, it plays a role in the development of semiconductors and as a reagent in organic synthesis.
When handling 2-Nitrobenzylcyanide (CAS: 610-66-2), it is essential to use personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize exposure. Spills should be handled carefully, using appropriate absorbents, and the area should be cleaned thoroughly. Refer to the Safety Data Sheet (SDS) for further detailed safety information.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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