510726
2-Cyanobenzophenone
97%
Synonym(s):
2-Benzoylbenzonitrile
Sign Into View Organizational & Contract Pricing
All Photos(1)
About This Item
Linear Formula:
NCC6H4OCC6H5
CAS Number:
Molecular Weight:
207.23
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Recommended Products
Assay
97%
mp
82-87 °C (lit.)
SMILES string
O=C(c1ccccc1)c2ccccc2C#N
InChI
1S/C14H9NO/c15-10-12-8-4-5-9-13(12)14(16)11-6-2-1-3-7-11/h1-9H
InChI key
XPBIJHFBORWDCM-UHFFFAOYSA-N
Related Categories
General description
2-Cyanobenzophenone, also known as 2-benzoylbenzonitrile, is a carbonyl-ene-nitrile compound. Its crystal structure belongs to the monoclinic space group, P21/c. 2-Cyanobenzophenone reacts with furan to form the corresponding adduct. Its reduction under electrochemical condition led to the formation of 2-t-butylbenzophenone, 3-t-butyl-3-phenylphthalide and 6-t-butyl-3-phenylphthalide.
Application
2-Cyanobenzophenone (2-benzoylbenzonitrile) may be used in the preparation of 3-phenyl-3H-isobenzofuran-1-ylidenamine.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Certificates of Analysis (COA)
Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.
Already Own This Product?
Find documentation for the products that you have recently purchased in the Document Library.
Copper-catalyzed Addition Reactions of Aromatics and Ketones to 2-Aza-2, 4-cyclopentadienone: Facile and Efficient Transformation of Carbonyl-ene-nitriles to 1 H-Pyrrolin-2 (5H)-ones.
Murai M, et al.
The Journal of Organic Chemistry, 73(22), 9174-9176 (2008)
An Efficient Synthesis of 3-Substituted 3H-Isobenzo-furan-1-ylidenamines by the Reaction of 2-Cyano-benzaldehydes with Organolithiums and Their Conversion into Isobenzofuran-1 (3H)-ones.
Kobayashi K, et al.
Heterocycles, 83(1), 99-99 (2011)
Electrochemical t-Butylation of Some Aromatic Ketones.
Kristensen LH and Lund H.
Acta Chemica Scandinavica. Series B, 33, 735-741 (1979)
Structure of 2-cyanobenzophenone.
Preut H, et al.
Acta Crystallographica Section C, Crystal Structure Communications, 48(5), 938-940 (1992)
Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.
Contact Technical Service