Cas no 102394-38-7 (Benzoxazole, 5-chloro-2-[(4-nitrophenyl)methyl]-)
![Benzoxazole, 5-chloro-2-[(4-nitrophenyl)methyl]- structure](https://ossimg.kuujia.com/scimg/102500/102394-38-7x500.png)
102394-38-7 structure
Product Name:Benzoxazole, 5-chloro-2-[(4-nitrophenyl)methyl]-
CAS No:102394-38-7
MF:C14H9ClN2O3
MW:288.68586230278
CID:1135337
Update Time:2024-07-27
Benzoxazole, 5-chloro-2-[(4-nitrophenyl)methyl]- Chemical and Physical Properties
Names and Identifiers
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- Benzoxazole, 5-chloro-2-[(4-nitrophenyl)methyl]-
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- Inchi： 1S/C14H9ClN2O3/c15-10-3-6-13-12(8-10)16-14(20-13)7-9-1-4-11(5-2-9)17(18)19/h1-6,8H,7H2
- InChI Key： JIVGSIMLSHYCIV-UHFFFAOYSA-N
- SMILES： O1C2=CC=C(Cl)C=C2N=C1CC1=CC=C([N+]([O-])=O)C=C1
Computed Properties
- Exact Mass: 288.03027
Experimental Properties
- Density: 1.423±0.06 g/cm3(Predicted)
- Boiling Point: 468.4±30.0 °C(Predicted)
- PSA: 69.17
- pka: -0.82±0.10(Predicted)
Benzoxazole, 5-chloro-2-[(4-nitrophenyl)methyl]- Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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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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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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