Cas no 37924-98-4 (1,2-Benzisoxazole, 3-(chloromethyl)-)
37924-98-4 structure
Product Name:1,2-Benzisoxazole, 3-(chloromethyl)-
CAS No:37924-98-4
MF:C8H6ClNO
MW:167.592340946198
CID:2102403
Update Time:2023-08-03
1,2-Benzisoxazole, 3-(chloromethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-BENZOXAZOLE, 3-(CHLOROMETHYL)-
- 3-(chloromethyl)benzo[d]isoxazole
- 1,2-Benzisoxazole, 3-(chloromethyl)-
-
- Inchi： 1S/C8H6ClNO/c9-5-7-6-3-1-2-4-8(6)11-10-7/h1-4H,5H2
- InChI Key： XTPQPGXMMWKUQJ-UHFFFAOYSA-N
- SMILES： ClCC1C2C=CC=CC=2ON=1
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 142
- Topological Polar Surface Area: 26
1,2-Benzisoxazole, 3-(chloromethyl)- Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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