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About This Item
线性分子式:
F2C6H3CN
CAS号:
分子量:
139.10
EC 号:
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22
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质量水平
方案
98%
折射率
n20/D 1.4882 (lit.)
密度
1.254 g/mL at 25 °C (lit.)
官能团
fluoro
nitrile
SMILES字符串
Fc1cccc(C#N)c1F
InChI
1S/C7H3F2N/c8-6-3-1-2-5(4-10)7(6)9/h1-3H
InChI key
GKPHNZYMLJPYJJ-UHFFFAOYSA-N
一般描述
Electronic transitions of 2,3-difluorobenzonitrile has been studied by photoacoustic spectroscopy.
应用
2,3-Difluorobenzonitrile has been used in the preparation of difluorophenyl-1,2,3,5-dithiadiazolyl and cyanophenoxazines.
警示用语：
Warning
危险分类
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
靶器官
Respiratory system
储存分类代码
10 - Combustible liquids
WGK
WGK 3
闪点(°F)
167.0 °F - closed cup
闪点(°C)
75 °C - closed cup
个人防护装备
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
法规信息
新产品
The effect of fluorinated aryl substituents on the crystal structures of 1, 2, 3, 5-dithiadiazolyl radicals.
Clarke CS, et al.
CrystEngComm, 12(1), 172-185 (2010)
Cyano-activated fluoro displacement reactions in the synthesis of cyanophenoxazines and related compounds.
Eastmond GC, et al.
New. J. Chem., 25(3), 385-390 (2001)
M Alcolea Palafox et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 57(12), 2373-2389 (2002-01-05)
Geometry, vibrational frequencies, atomic charges and several thermodynamic parameters (the total energy, the zero point energy, the rotational constants and the room temperature entropy) were calculated using ab initio quantum chemical methods for 2,3-difluorobenzonitrile molecule. The results were compared with
Two electronic transitions in the near-UV region of six isomeric difluorobenzonitriles-I.
Ramu K, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy, 49(2), 223-236 (1993)
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