Cas no 97460-00-9 (2-Pyrimidinamine,N-nitroso-)
2-Pyrimidinamine,N-nitroso- structure
Product Name:2-Pyrimidinamine,N-nitroso-
CAS No:97460-00-9
MF:C4H4N4O
MW:124.100759506226
CID:801122
PubChem ID:434495
Update Time:2025-04-19
2-Pyrimidinamine,N-nitroso- Chemical and Physical Properties
Names and Identifiers
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- 2-Pyrimidinamine,N-nitroso-
- 2-Pyrimidinamine, N-nitroso- (9CI)
- 2-Pyrimidinamine,N-nitroso-(9ci)
- 97460-00-9
-
- Inchi： 1S/C4H4N4O/c9-8-7-4-5-2-1-3-6-4/h1-3H,(H,5,6,7,9)
- InChI Key： MCOPJSBJRDFMEB-UHFFFAOYSA-N
- SMILES： O=NNC1N=CC=CN=1
Computed Properties
- Exact Mass: 124.03851076g/mol
- Monoisotopic Mass: 124.03851076g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 90.6
- 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: 0.2
- Topological Polar Surface Area: 67.2?2
2-Pyrimidinamine,N-nitroso- Related Literature
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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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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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
97460-00-9 (2-Pyrimidinamine,N-nitroso-) Related Products
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