3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione
Basic information
- CAS
5770-19-4- Standard SMILES
CNc1[nH]c(=O)n(C)c(=O)c1N=O- InChIKey
BDGPUPPAEXFPRL-UHFFFAOYSA-N- Molecular formula
- C6H8N4O3
- Average molar mass
- 184.15 g/mol
- Monoisotopic mass
- 184.05964013
Names & identifiers
- Preferred name
- 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione
- IUPAC
- 3-methyl-6-(methylamino)-5-nitroso-1H-pyrimidine-2,4-dione
Names & synonyms
5770-19-43-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dioneSTK397039NSC81009DTXSID60292227CCG-40405NSC-81009AKOS005434015DS-004918ST509002023-Methyl-6-methylamino-5-nitroso-1h-pyrimidine-2,4-dione3-methyl-6-(methylamino)-5-nitroso-1,3-dihydropyrimidine-2,4-dione
Database identifiers
- CAS
5770-19-4- PubChem CID
- 255443
- DTXSID
DTXSID60292227
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 90.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 309
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Compound notes
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