510726
2-氰基二苯甲酮
97%
别名:
2-苯甲酰苯甲腈
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关于此项目
线性分子式:
NCC6H4OCC6H5
化学文摘社编号:
分子量:
207.23
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22
质量水平
方案
97%
mp
82-87 °C (lit.)
官能团
ketone
nitrile
phenyl
SMILES字符串
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
一般描述
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.
应用
2-Cyanobenzophenone (2-benzoylbenzonitrile) may be used in the preparation of 3-phenyl-3H-isobenzofuran-1-ylidenamine.
警示用语：
Warning
危险声明
危险分类
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
靶器官
Respiratory system
储存分类代码
11 - Combustible Solids
WGK
WGK 3
闪点(°F)
Not applicable
闪点(°C)
Not applicable
个人防护装备
dust mask type N95 (US), Eyeshields, Gloves
法规信息
新产品
此项目有
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)
Structure of 2-cyanobenzophenone.
Preut H, et al.
Acta Crystallographica Section C, Crystal Structure Communications, 48(5), 938-940 (1992)
Electrochemical t-Butylation of Some Aromatic Ketones.
Kristensen LH and Lund H.
Acta Chemica Scandinavica. Series B, 33, 735-741 (1979)
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