Basic information
- CAS
17224-46-3- Standard SMILES
CC(=O)C(CN(C)C)=NO.Cl- InChIKey
OSLZTCJHQUDKNL-UHFFFAOYSA-N- Molecular formula
- C6H13ClN2O2
- Average molar mass
- 180.63 g/mol
- Monoisotopic mass
- 180.06655534
Names & identifiers
- Preferred name
- 2-Hydroxyimino-1-Dimethylamino-3-Butanone Hydrochloride
- IUPAC
- 4-(dimethylamino)-3-hydroxyiminobutan-2-one;hydrochloride
Names & synonyms
17224-46-3SCHEMBL11472684DTXSID70938104OSLZTCJHQUDKNL-UHFFFAOYSA-N2-Hydroxyimino-1-Dimethylamino-3-Butanone Hydrochloride4-(Dimethylamino)-3-(hydroxyimino)butan-2-one--hydrogen chloride (1/1)
Database identifiers
- CAS
17224-46-3- PubChem CID
- 76175205
- DTXSID
DTXSID70938104
Properties
Computed structural properties
- Topological polar surface area
- 52.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 152
Related reactions
2 records
Compound notes
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