Cas no 187231-25-0 (4-Cinnolinamine, 7-methyl-)
4-Cinnolinamine, 7-methyl- structure
Product Name:4-Cinnolinamine, 7-methyl-
CAS No:187231-25-0
MF:C9H9N3
MW:159.187861204147
CID:1382929
Update Time:2024-08-16
4-Cinnolinamine, 7-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 4-Cinnolinamine, 7-methyl-
- 7-Methylcinnolin-4-amine
-
- Inchi： 1S/C9H9N3/c1-6-2-3-7-8(10)5-11-12-9(7)4-6/h2-5H,1H3,(H2,10,12)
- InChI Key： CRVHOOJFNZLFMO-UHFFFAOYSA-N
- SMILES： N1=C2C(C=CC(C)=C2)=C(N)C=N1
Computed Properties
- Exact Mass: 159.07977
Experimental Properties
- Density: 1.238±0.06 g/cm3(Predicted)
- Boiling Point: 361.6±34.0 °C(Predicted)
- PSA: 51.8
- pka: 7.45±0.10(Predicted)
4-Cinnolinamine, 7-methyl- Related Literature
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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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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