Cas no 64359-54-2 (4(3H)-Pyrimidinone, 3-methyl-2-(methylamino)-)
64359-54-2 structure
Product Name:4(3H)-Pyrimidinone, 3-methyl-2-(methylamino)-
CAS No:64359-54-2
MF:C6H9N3O
MW:139.155160665512
CID:1678392
PubChem ID:21854537
Update Time:2025-04-21
4(3H)-Pyrimidinone, 3-methyl-2-(methylamino)- Chemical and Physical Properties
Names and Identifiers
-
- 4(3H)-Pyrimidinone, 3-methyl-2-(methylamino)-
- 3-methyl-2-(methylamino)pyrimidin-4-one
- 3-Methyl-2-(methylamino)pyrimidin-4(3H)-one
- DTXSID30618854
- AKOS006353652
- 64359-54-2
-
- Inchi： 1S/C6H9N3O/c1-7-6-8-4-3-5(10)9(6)2/h3-4H,1-2H3,(H,7,8)
- InChI Key： RWNAZOMSPJUEGO-UHFFFAOYSA-N
- SMILES： O=C1C=CN=C(NC)N1C
Computed Properties
- Exact Mass: 139.07467
- Monoisotopic Mass: 139.074561919g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 207
- 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: -0.7
- Topological Polar Surface Area: 44.7?2
Experimental Properties
- PSA: 44.7
4(3H)-Pyrimidinone, 3-methyl-2-(methylamino)- Related Literature
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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4. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Mei Zhang,Jingjing Guo,Tingting Liu,Zhanyu He,Majeed Irfan,Zujin Zhao,Zhuo Zeng J. Mater. Chem. C, 2020,8, 14919-14924
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