Basic information
- CAS
74274-12-7- Standard SMILES
CC(CCN1C(=O)c2ccccc2C1=O)=NO- InChIKey
LEUMAKYUPKUKIW-UHFFFAOYSA-N- Molecular formula
- C12H12N2O3
- Average molar mass
- 232.23 g/mol
- Monoisotopic mass
- 232.08479224
Names & identifiers
- Preferred name
- 2-[3-(Hydroxyimino)butyl]-1H-isoindole-1,3(2H)-dione
- IUPAC
- 2-(3-hydroxyiminobutyl)isoindole-1,3-dione
Names & synonyms
74274-12-7SCHEMBL94679062-[3-(Hydroxyimino)butyl]-1H-isoindole-1,3(2H)-dioneDTXSID50824874LEUMAKYUPKUKIW-UHFFFAOYSA-NN-[3-(N-hydroxyimino)butyl]phthalimideN-[3-(N-hydroxyimino)butyl]-phthalimide
Database identifiers
- CAS
74274-12-7- PubChem CID
- 71404003
- DTXSID
DTXSID50824874
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 70 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 341
Related reactions
4 records
Compound notes
Loading…