Basic information
- CAS
61588-82-7- Standard SMILES
O=C1CC2(CCCCC2)C(=O)N1c1cccc([N+](=O)[O-])c1- InChIKey
YLCWSQOJIOTBJP-UHFFFAOYSA-N- Molecular formula
- C15H16N2O4
- Average molar mass
- 288.3 g/mol
- Monoisotopic mass
- 288.111007
Names & identifiers
- Preferred name
- 2-Azaspiro[4.5]decane-1,3-dione, 2-(3-nitrophenyl)-
- IUPAC
- 2-(3-nitrophenyl)-2-azaspiro[4.5]decane-1,3-dione
Names & synonyms
2-Azaspiro[4.5]decane-1,3-dione, 2-(3-nitrophenyl)-61588-82-7DTXSID404850342-(3-NITROPHENYL)-2-AZASPIRO[4.5]DECANE-1,3-DIONE
Database identifiers
- CAS
61588-82-7- PubChem CID
- 12291981
- DTXSID
DTXSID40485034
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 83.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 465
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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