Cas no 56983-60-9 (4,6(1H,5H)-Pyrimidinedione, 2-amino-5-nitroso-)
56983-60-9 structure
Product Name:4,6(1H,5H)-Pyrimidinedione, 2-amino-5-nitroso-
CAS No:56983-60-9
MF:C4H5N5O2
MW:155.114799261093
CID:386224
Update Time:2024-01-29
4,6(1H,5H)-Pyrimidinedione, 2-amino-5-nitroso- Chemical and Physical Properties
Names and Identifiers
-
- 4,6(1H,5H)-Pyrimidinedione, 2-amino-5-nitroso-
- 2,4-Diamino-6-hydroxy-5-nitrosopyrimidine
- 2-amino-5-nitroso-1H-pyrimidine-4,6-dione
- 2-Amino-5-nitrosopyrimidine-4,6-dione
- AC1L863W
- AG-G-00699
- CTK1H4894
- NSC278892
- NSC-278892
- 2 4-DIAMINO-6-HYDROXY-5-NITROS0PYRIMIDINE
-
- Inchi： 1S/C4H5N5O2/c5-2-1(9-11)3(10)8-4(6)7-2/h(H5,5,6,7,8,10)
- InChI Key： HVMRLFSFHWCUCG-UHFFFAOYSA-N
- SMILES： C1(N)=NC(O)=C(N=O)C(N)=N1
Computed Properties
- Exact Mass: 156.02842
- Monoisotopic Mass: 156.028
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 258
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
Experimental Properties
- Density: 2.19
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.861
- PSA: 113.98
- LogP: -1.44280
4,6(1H,5H)-Pyrimidinedione, 2-amino-5-nitroso- Related Literature
-
Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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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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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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