Acetamide, N-(methylnitrosoaminomethyl)-
Basic information
- CAS
59665-11-1- Standard SMILES
CC(=O)NCN(C)N=O- InChIKey
WUQBANNXOPWADH-UHFFFAOYSA-N- Molecular formula
- C4H9N3O2
- Average molar mass
- 131.13 g/mol
- Monoisotopic mass
- 131.06947654
Names & identifiers
- Preferred name
- Acetamide, N-(methylnitrosoaminomethyl)-
- IUPAC
- N-[[methyl(nitroso)amino]methyl]acetamide
- English name
- N-Methyl-N-acetylaminomethyl-nitrosamine
- Molecular formula
- C4H9N3O2
- Molecular weight
- 131.13
Names & synonyms
59665-11-1N-[[methyl(nitroso)amino]methyl]acetamideACETAMIDE, N-(METHYLNITROSOAMINOMETHYL)-P4B9BQH6QRNSC-239278N-((Methylnitrosoamino)methyl)acetamideN-{[METHYL(NITROSO)AMINO]METHYL}ACETAMIDEN-Methyl-N-acetylaminomethylnitrosamineBRN 2431854NSC239278UNII-P4B9BQH6QRWLN: ONN1&1MV1
Show more names
N-(Methylnitrosoaminomethyl)acetamideN-[(Methylnitrosamino)methyl]acetamideN-[(Methylnitrosoamino)methyl]acetamideN-Methyl-N-acetylaminomethyl-nitrosamineN-Methyl-N-(acetylaminomethyl)nitrosoamine
DTXSID90208356AKOS006278704NSC 239278Acetamide, N-[(methylnitrosoamino)methyl]-
Database identifiers
- CAS
59665-11-1- PubChem CID
- 43057
- DTXSID
DTXSID90208356- UNII
- P4B9BQH6QR
- Nikkaji
- J2.789H
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 114
Physicochemical properties
- Boiling point
- 242.43 °C · 242.43°C (rough estimate)
- Density
- 1.3227 · 1.3227 (rough estimate)
- refractive index
- 1.57 · 1.5700 (estimate)
- FDA UNII
- 4 B9BQH6QR · P4B9BQH6QR
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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