Cas no 848395-13-1 (1,2,4-Benzotriazin-3-amine, N-phenyl-, 1,4-dioxide)
848395-13-1 structure
Product Name:1,2,4-Benzotriazin-3-amine, N-phenyl-, 1,4-dioxide
CAS No:848395-13-1
MF:C13H10N4O2
MW:254.24410200119
CID:583198
Update Time:2024-01-31
1,2,4-Benzotriazin-3-amine, N-phenyl-, 1,4-dioxide Chemical and Physical Properties
Names and Identifiers
-
- 1,2,4-Benzotriazin-3-amine, N-phenyl-, 1,4-dioxide
- 4-hydroxy-1-oxido-N-phenyl-1,2,4-benzotriazin-1-ium-3-imine
-
- Inchi： 1S/C13H10N4O2/c18-16-11-8-4-5-9-12(11)17(19)15-13(16)14-10-6-2-1-3-7-10/h1-9H,(H,14,15)
- InChI Key： BCPFZAHMDQBKPE-UHFFFAOYSA-N
- SMILES： [N+]1([O-])C2=CC=CC=C2[N+]([O-])=C(NC2=CC=CC=C2)N=1
Experimental Properties
- Density: 1.39±0.1 g/cm3(Predicted)
- Melting Point: 203-204 °C
- Boiling Point: 505.4±33.0 °C(Predicted)
- pka: 1.06±0.30(Predicted)
1,2,4-Benzotriazin-3-amine, N-phenyl-, 1,4-dioxide Related Literature
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Xu Jie,Deng Xu,Weili Wei RSC Adv., 2019,9, 29149-29153
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