Cas no 98338-06-8 (2,4,5-Pyrimidinetriamine, 6-(1-methylethyl)-)
98338-06-8 structure
Product Name:2,4,5-Pyrimidinetriamine, 6-(1-methylethyl)-
CAS No:98338-06-8
MF:C7H13N5
MW:167.211620092392
CID:750638
PubChem ID:15162784
Update Time:2025-04-19
2,4,5-Pyrimidinetriamine, 6-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2,4,5-Pyrimidinetriamine, 6-(1-methylethyl)-
- 6-propan-2-ylpyrimidine-2,4,5-triamine
- DTXSID80569362
- 6-(Propan-2-yl)pyrimidine-2,4,5-triamine
- 98338-06-8
-
- Inchi： 1S/C7H13N5/c1-3(2)5-4(8)6(9)12-7(10)11-5/h3H,8H2,1-2H3,(H4,9,10,11,12)
- InChI Key： QIEYSPQYYMUFMI-UHFFFAOYSA-N
- SMILES： N1C(N)=NC(=C(C=1C(C)C)N)N
Computed Properties
- Exact Mass: 167.11709544g/mol
- Monoisotopic Mass: 167.11709544g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 149
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0
- Topological Polar Surface Area: 104?2
2,4,5-Pyrimidinetriamine, 6-(1-methylethyl)- Related Literature
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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