Cas no 66542-13-0 (N''-Methyl-N-nitro-N'-nitrosoguanidine)
66542-13-0 structure
Product Name:N''-Methyl-N-nitro-N'-nitrosoguanidine
CAS No:66542-13-0
MF:C2H5N5O3
MW:147.092798948288
CID:2796027
PubChem ID:13146027
Update Time:2025-04-21
N''-Methyl-N-nitro-N'-nitrosoguanidine Chemical and Physical Properties
Names and Identifiers
-
- DTXSID00521861
- DTXCID00472667
- SCHEMBL8581312
- N''-Methyl-N-nitro-N'-nitrosoguanidine
- N-methyl-N'-nitro-N''-nitrosoguanidine
- 2-methyl-3-nitro-nitrosoguanidine
- 66542-13-0
- SCHEMBL1536062
-
- Inchi： 1S/C2H5N5O3/c1-3-2(4-6-8)5-7(9)10/h1H3,(H2,3,4,5,8)
- InChI Key： POJDZWIPNZWPAU-UHFFFAOYSA-N
- SMILES： [O-][N+](N/C(=N/C)/NN=O)=O
Computed Properties
- Exact Mass: 147.03923904Da
- Monoisotopic Mass: 147.03923904Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 159
- 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
- Topological Polar Surface Area: 112?2
N''-Methyl-N-nitro-N'-nitrosoguanidine Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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