Basic information
- CAS
127692-24-4- Standard SMILES
O=[N+]([O-])c1cn2c(n1)OC1(CCCCC1)C2- InChIKey
LWGZQFMDSZYGQM-UHFFFAOYSA-N- Molecular formula
- C10H13N3O3
- Average molar mass
- 223.23 g/mol
- Monoisotopic mass
- 223.09569129
Names & identifiers
- Preferred name
- Spiro(cyclohexane-1,2'(3'H)-imidazo(2,1-b)oxazole), 6'-nitro-
- IUPAC
- 6-nitrospiro[3H-imidazo[2,1-b][1,3]oxazole-2,1'-cyclohexane]
Names & synonyms
127692-24-4Spiro(cyclohexane-1,2'(3'H)-imidazo(2,1-b)oxazole), 6'-nitro-Spiro[cyclohexane-1,2'(3'H)-imidazo[2,1-b]oxazole], 6'-nitro-DTXSID801556286-nitrospiro[3H-imidazo[2,1-b]oxazole-2,1'-cyclohexane]6'-NITRO-3'H-SPIRO[CYCLOHEXANE-1,2'-IMIDAZO[2,1-B][1,3]OXAZOLE]
Database identifiers
- CAS
127692-24-4- PubChem CID
- 460741
- DTXSID
DTXSID80155628
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 298
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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