Basic information
- CAS
584-92-9- Standard SMILES
CCCCCC(=NO)C(C)=O- InChIKey
CVRXVGUWTKLMFD-UHFFFAOYSA-N- Molecular formula
- C8H15NO2
- Average molar mass
- 157.21 g/mol
- Monoisotopic mass
- 157.11027872
Names & identifiers
- Preferred name
- 3-Oximino-2-octanone
- IUPAC
- 3-hydroxyiminooctan-2-one
Names & synonyms
584-92-93-oximino-2-octanoneOctane-2,3-dione 3-oxime3-(hydroxyimino)octan-2-oneSCHEMBL11334623DTXSID20879250CVRXVGUWTKLMFD-UHFFFAOYSA-N
Database identifiers
- CAS
584-92-9- PubChem CID
- 6798159
- DTXSID
DTXSID20879250
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 152
Related reactions
11 records
Compound notes
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