Basic information
- CAS
14854-16-1- Standard SMILES
O=C1N(O)C2(C=CCC2)C(=O)C12CCCC2- InChIKey
YMDRQLPIYSMFFS-UHFFFAOYSA-N- Molecular formula
- C12H15NO3
- Average molar mass
- 221.25 g/mol
- Monoisotopic mass
- 221.10519334
Names & identifiers
- Preferred name
- N-Hydroxy-12-azadispiro(4,1,4,2)tridec-8-ene-6,13-dione
- IUPAC
- 12-hydroxy-12-azadispiro[4.1.47.25]tridec-10-ene-6,13-dione
Names & synonyms
14854-16-1N-Hydroxy-12-azadispiro(4,1,4,2)tridec-8-ene-6,13-dioneYMDRQLPIYSMFFS-UHFFFAOYSA-DTXSID40340598YMDRQLPIYSMFFS-UHFFFAOYSA-N12-Azadispiro[4.1.4.2]tridec-10-ene-6,13-dione, 12-hydroxy-12-Hydroxy-12-azadispiro[4.1.4.2]tridec-8-ene-6,13-dione #12-Hydroxy-12-azadispiro[4.1.4~7~.2~5~]tridec-8-ene-6,13-dioneInChI=1/C12H15NO3/c14-9-11(5-1-2-6-11)10(15)13(16)12(9)7-3-4-8-12/h3,7,16H,1-2,4-6,8H2
Database identifiers
- CAS
14854-16-1- PubChem CID
- 565983
- DTXSID
DTXSID40340598
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 395
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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