2(1H)-Pyrimidinone, tetrahydro-1-nitroso-
Basic information
- CAS
62641-66-1- Standard SMILES
O=NN1CCCNC1=O- InChIKey
UQKPGXYENGNTCJ-UHFFFAOYSA-N- Molecular formula
- C4H7N3O2
- Average molar mass
- 129.12 g/mol
- Monoisotopic mass
- 129.05382648
Names & identifiers
- Preferred name
- 2(1H)-Pyrimidinone, tetrahydro-1-nitroso-
- IUPAC
- 1-nitroso-1,3-diazinan-2-one
- English name
- 2(1H)-Pyrimidinone, tetrahydro-1-nitroso-
- Molecular formula
- C4H7N3O2
- Molecular weight
- 129.12
Names & synonyms
Propylenenitrosourea62641-66-12(1H)-Pyrimidinone, tetrahydro-1-nitroso-BRN 05122681-Nitroso-tetrahydro-2(1H)-pyrihidinoneDTXSID40211698NSC 75950RefChem:80455DTXCID701341895-24-01-00207 (Beilstein Handbook Reference)NSC-759501-nitroso-1,3-diazinan-2-one
Show more names
3,4,5,6-Tetrahydro-1-nitroso-2(1H)-pyrimidinone
Propylene-nitrosoureaNSC75950RP4KF4TW7JAKOS006275915Tetrahydro-1-nitroso-2(1H)-pyrimidinone8-quinolinolium 4,7-dibromo-3-hydroxy-2-naphthoate, Copper (ii) Salt
Database identifiers
- CAS
62641-66-1- PubChem CID
- 96485
- DTXSID
DTXSID40211698- UNII
- RP4KF4TW7J
- Nikkaji
- J1.111H
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 136
Physicochemical properties
- Boiling point
- 239.15 °C · 239.15°C (rough estimate)
- Density
- 1.3936 · 1.3936 (rough estimate)
- refractive index
- 1.57 · 1.5700 (estimate)
- EWG's Food Scores
- 1 · 1
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Related reactions
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Compound notes
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