Cas no 100524-49-0 (2,4,5-Pyrimidinetriamine,N2-ethyl-)
100524-49-0 structure
Product Name:2,4,5-Pyrimidinetriamine,N2-ethyl-
CAS No:100524-49-0
MF:C6H11N5
MW:153.185039758682
CID:124142
PubChem ID:76852118
Update Time:2025-04-18
2,4,5-Pyrimidinetriamine,N2-ethyl- Chemical and Physical Properties
Names and Identifiers
-
- 2,4,5-Pyrimidinetriamine,N2-ethyl-
- Pyrimidine, 4,5-diamino-2-ethylamino- (6CI)
- 100524-49-0
- N2-Ethylpyrimidine-2,4,5-triamine
- N2-Ethyl-2,4,5-pyrimidinetriamine
- Pyrimidine, 4,5-diamino-2-ethylamino- (6CI)
-
- Inchi： 1S/C6H11N5/c1-2-9-6-10-3-4(7)5(8)11-6/h3H,2,7H2,1H3,(H3,8,9,10,11)
- InChI Key： WBWBOURCSZDXMI-UHFFFAOYSA-N
- SMILES： N(C1N=CC(=C(N)N=1)N)CC
Computed Properties
- Exact Mass: 153.101445g/mol
- Monoisotopic Mass: 153.101445g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 118
- 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
- Molecular Weight: 153.19g/mol
- XLogP3: -0.1
- Topological Polar Surface Area: 89.8?2
2,4,5-Pyrimidinetriamine,N2-ethyl- Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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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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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
100524-49-0 (2,4,5-Pyrimidinetriamine,N2-ethyl-) Related Products
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