Cas no 187231-26-1 (4-Cinnolinamine, 6,7-dimethyl-)
187231-26-1 structure
Product Name:4-Cinnolinamine, 6,7-dimethyl-
CAS No:187231-26-1
MF:C10H11N3
MW:173.214441537857
CID:1382930
Update Time:2024-08-16
4-Cinnolinamine, 6,7-dimethyl- Chemical and Physical Properties
Names and Identifiers
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- 4-Cinnolinamine, 6,7-dimethyl-
-
- Inchi： 1S/C10H11N3/c1-6-3-8-9(11)5-12-13-10(8)4-7(6)2/h3-5H,1-2H3,(H2,11,13)
- InChI Key： ZSSUVSWEHPSZTA-UHFFFAOYSA-N
- SMILES： N1=C2C(C=C(C)C(C)=C2)=C(N)C=N1
Computed Properties
- Exact Mass: 173.09543
Experimental Properties
- Density: 1.195±0.06 g/cm3(Predicted)
- Boiling Point: 378.9±34.0 °C(Predicted)
- PSA: 51.8
- pka: 7.63±0.10(Predicted)
4-Cinnolinamine, 6,7-dimethyl- Related Literature
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Xu Jie,Deng Xu,Weili Wei RSC Adv., 2019,9, 29149-29153
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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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Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
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Vitaly Gurylev,Chung-Yi Su,Tsong-Pyng Perng Phys. Chem. Chem. Phys., 2016,18, 16033-16038
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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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