Cas no 66678-78-2 (1,3,5-Triazin-2(1H)-one, 4-amino-5,6-dihydro-5-methyl-)
66678-78-2 structure
Product Name:1,3,5-Triazin-2(1H)-one, 4-amino-5,6-dihydro-5-methyl-
CAS No:66678-78-2
MF:C4H8N4O
MW:128.132519721985
CID:395966
PubChem ID:13361918
Update Time:2025-04-19
1,3,5-Triazin-2(1H)-one, 4-amino-5,6-dihydro-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,3,5-Triazin-2(1H)-one, 4-amino-5,6-dihydro-5-methyl-
- 4-amino-3-methyl-1,2-dihydro-1,3,5-triazin-6-one
- AKOS006378140
- SCHEMBL11104026
- 4-Amino-5-methyl-5,6-dihydro-1,3,5-triazin-2(1H)-one
- 66678-78-2
- DTXSID70538289
-
- Inchi： 1S/C4H8N4O/c1-8-2-6-4(9)7-3(8)5/h2H2,1H3,(H3,5,6,7,9)
- InChI Key： MSXHELYNAXADMT-UHFFFAOYSA-N
- SMILES： O=C1N=C(N)N(C)CN1
Computed Properties
- Exact Mass: 128.06994
- Monoisotopic Mass: 128.06981089g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 164
- 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: -1.3
- Topological Polar Surface Area: 70.7?2
Experimental Properties
- PSA: 70.72
1,3,5-Triazin-2(1H)-one, 4-amino-5,6-dihydro-5-methyl- Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Chen Long,Ying Dai,Jianwei Li,Hao Jin Nanoscale, 2020,12, 21124-21130
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