Cas no 31469-62-2 (2,6-diamino-3-methylpyrimidin-4(3H)-one)
31469-62-2 structure
Product Name:2,6-diamino-3-methylpyrimidin-4(3H)-one
CAS No:31469-62-2
MF:C5H8N4O
MW:140.143219947815
CID:2821723
PubChem ID:12896489
Update Time:2025-04-21
2,6-diamino-3-methylpyrimidin-4(3H)-one Chemical and Physical Properties
Names and Identifiers
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- SCHEMBL6403829
- AKOS006338215
- DTXSID70512509
- 2,6-diamino-3-methylpyrimidin-4(3H)-one
- 31469-62-2
-
- Inchi： 1S/C5H8N4O/c1-9-4(10)2-3(6)8-5(9)7/h2H,6H2,1H3,(H2,7,8)
- InChI Key： OLMPHFHPDJLTFY-UHFFFAOYSA-N
- SMILES： O=C1C=C(N)N=C(N)N1C
Computed Properties
- Exact Mass: 140.06981089Da
- Monoisotopic Mass: 140.06981089Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 230
- 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: -1.6
- Topological Polar Surface Area: 84.7?2
2,6-diamino-3-methylpyrimidin-4(3H)-one Related Literature
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
31469-62-2 (2,6-diamino-3-methylpyrimidin-4(3H)-one) Related Products
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