Cas no 180903-19-9 (1H-Pyrazolo[3,4-d]pyrimidin-4-amine,3-(2-chlorophenyl)-1-(1,1-dimethylethyl)-)
![1H-Pyrazolo[3,4-d]pyrimidin-4-amine,3-(2-chlorophenyl)-1-(1,1-dimethylethyl)- structure](https://ossimg.kuujia.com/scimg/181000/180903-19-9x500.png)
180903-19-9 structure
Product Name:1H-Pyrazolo[3,4-d]pyrimidin-4-amine,3-(2-chlorophenyl)-1-(1,1-dimethylethyl)-
CAS No:180903-19-9
MF:C15H16ClN5
MW:301.774041175842
CID:1372300
Update Time:2024-08-16
1H-Pyrazolo[3,4-d]pyrimidin-4-amine,3-(2-chlorophenyl)-1-(1,1-dimethylethyl)- Chemical and Physical Properties
Names and Identifiers
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- 1H-Pyrazolo[3,4-d]pyrimidin-4-amine,3-(2-chlorophenyl)-1-(1,1-dimethylethyl)-
- 1H-Pyrazolo[3,4-d]pyrimidin-4-amine, 3-(2-chlorophenyl)-1-(1,1-dimethylethyl)-
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- Inchi： 1S/C15H16ClN5/c1-15(2,3)21-14-11(13(17)18-8-19-14)12(20-21)9-6-4-5-7-10(9)16/h4-8H,1-3H3,(H2,17,18,19)
- InChI Key： JCDPEKUOFGPIQW-UHFFFAOYSA-N
- SMILES： C1=NC(N)=C2C(C3=CC=CC=C3Cl)=NN(C(C)(C)C)C2=N1
Computed Properties
- Exact Mass: 301.10968
Experimental Properties
- Density: 1.35±0.1 g/cm3(Predicted)
- Boiling Point: 479.7±40.0 °C(Predicted)
- PSA: 69.62
- pka: 3.90±0.30(Predicted)
1H-Pyrazolo[3,4-d]pyrimidin-4-amine,3-(2-chlorophenyl)-1-(1,1-dimethylethyl)- Related Literature
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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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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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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