Basic information
- CAS
80354-48-9- Standard SMILES
CN(N=O)C(=O)ON1C(=O)CCC1=O- InChIKey
HOLCTFBQQQICEX-UHFFFAOYSA-N- Molecular formula
- C6H7N3O5
- Average molar mass
- 201.14 g/mol
- Monoisotopic mass
- 201.03857033
Names & identifiers
- Preferred name
- Carbamic acid, methylnitroso-2,5-dioxo-1-pyrrolidinyl ester
- IUPAC
- (2,5-dioxopyrrolidin-1-yl) N-methyl-N-nitrosocarbamate
- English name
- (2,5-dioxopyrrolidin-1-yl) N-Methyl-N-nitrosocarbaMate
- Molecular formula
- C6H7N3O5
- Molecular weight
- 201.14
Names & synonyms
80354-48-9ICIG 1732Methylnitrosocarbamic acid 2,5-dioxo-1-pyrrolidinyl esterBRN 5048147N-Methyl N-nitroso-carbamate de succinimidyle [French]N-Methyl N-nitroso-carbamate de succinimidyleDTXSID602302602,5-Pyrrolidinedione, 1-(((methylnitrosoamino)carbonyl)oxy)-RefChem:332581DTXCID60152751Carbamic acid, methylnitroso-2,5-dioxo-1-pyrrolidinyl esterCARBAMIC ACID, METHYLNITROSO- 2,5-DIOXO-1-PYRROLIDINYL ESTER
Show more names
(2,5-dioxopyrrolidin-1-yl) N-Methyl-N-nitrosocarbaMate2,5-Pyrrolidinedione, 1-[[(methylnitrosoamino)carbonyl]oxy]- (9CI)
NSC6410791-[(2,5-DIOXOPYRROLIDIN-1-YL)OXY]-N-METHYL-N'-OXOFORMOHYDRAZIDECHEMBL301386NSC-641079NCI60_0137712,5-Dioxopyrrolidin-1-yl methyl(nitroso)carbamate(2,5-dioxopyrrolidin-1-yl) N-methyl-N-nitroso-carbamate1-(((1-Methyl-2-oxohydrazino)carbonyl)oxy)-2,5-pyrrolidinedione
Database identifiers
- CAS
80354-48-9
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 96.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 286
Physicochemical properties
- Boiling point
- 286.1 · 286.1±23.0 °C(Predicted)
- Density
- 1.65 · 1.65±0.1 g/cm3(Predicted)
- pka
- -3.23 · -3.23±0.70(Predicted)
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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