273-92-7 ((1,2,3-Benzoselenadiazole)

快速询单

结构式：

1,2,3-BenzoselenadiazoleMOL文件

CAS号：

273-92-7

英文名称：

1,2,3-Benzoselenadiazole

分子式：

C₆H₄N₂Se

分子量：

183.069359779358

1,2,3-Benzoselenadiazole(273-92-7)名称与标识符

名称

英文别名：

1,2,3-Benzoselenadiazole;SCHEMBL163855;DTXSID20181749;benzoselenadiazole;273-92-7;

标识符

InChIKey：

TVNJKAZMPQNGGE-UHFFFAOYSA-N

Inchi：

1S/C6H4N2Se/c1-2-4-6-5(3-1)7-8-9-6/h1-4H

SMILES：

[Se]1C2C=CC=CC=2N=N1

1,2,3-Benzoselenadiazole(273-92-7)物化性质

实验特性

PSA : 24.72
沸点 : 248.9°Cat760mmHg
闪点 : 104.4°C

计算特性

精确分子量 : 177.96002
氢键供体数量 : 0
氢键受体数量 : 2
可旋转化学键数量 : 0
同位素质量 : 183.954
重原子数量 : 9
复杂度 : 107
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
拓扑分子极性表面积 : 25.8Å²

1,2,3-Benzoselenadiazole(273-92-7)相关文献

1. 1,2,3-Benzothiadiazole. Part VI. Investigations on the quaternisation of 1,2,3-benzothiadiazole and 1,2,3-benzoselenadiazole
G. A. Jaffari,A. J. Nunn,J. T. Ralph J. Chem. Soc. C 1970 2060
2. Dibenzotetraselenafulvalene (DBTSF). Synthesis and conducting salts
Ib Johannsen,Klaus Bechgaard,Kell Mortensen,Claus Jacobsen J. Chem. Soc. Chem. Commun. 1983 295
3. The synergy between a benzoselenadiazole covalent organic framework and TEMPO for selective photocatalytic aerobic oxidation of organic sulfides
Hongxiang Zhao,Fulin Zhang,Xiaoyun Dong,Xianjun Lang J. Mater. Chem. A 2023 11 18115
4. Index of subjects, 1970
J. Chem. Soc. C 1970 2733
5. Benzoselenadiazole-based responsive long-lifetime photoluminescent probes for protein kinases
Ramesh Ekambaram,Erki Enkvist,Ganesh babu Manoharan,Mihkel Ugandi,Marje Kasari,Kaido Viht,Stefan Knapp,Olaf-Georg Issinger,Asko Uri Chem. Commun. 2014 50 4096
6. On the inverse correlation between the hydrogen bond strength and chalcogen bond strength in the cyclic supramolecular heterosynthon [–Se–N]?[HOOC–]
Honghong Lan,Shaobin Miao,Yu Zhang,Weizhou Wang CrystEngComm 2023 25 2159
7. Molecular weight and end capping effects on the optoelectronic properties of structurally related ‘heavy atom’ donor–acceptor polymers
Gregory L. Gibson,Dong Gao,Ashlee A. Jahnke,Jing Sun,Andrew J. Tilley,Dwight S. Seferos J. Mater. Chem. A 2014 2 14468
8. 912. 2,1,3-Benzoselenadiazoles as intermediates in o-phenylenediamine synthesis
C. W. Bird,G. W. H. Cheeseman,A. A. Sarsfield J. Chem. Soc. 1963 4767
9. Effects of the acceptor pattern and substitution position on the properties of N-phenyl-carbazolyl based donor–acceptor–donor molecules
Xuejing Song,Min Wang,Lingqian Kong,Jinsheng Zhao RSC Adv. 2017 7 18189
10. Effective modulation of the photoluminescence properties of 2,1,3-benzothiadiazoles and 2,1,3-benzoselenadiazoles by Pd-catalyzed C–H bond arylations
Imane Idris,Thibault Tannoux,Fazia Derridj,Vincent Dorcet,Julien Boixel,Veronique Guerchais,Jean-Fran?ois Soulé,Henri Doucet J. Mater. Chem. C 2018 6 1731