Basic information
- CAS
127692-25-5- Standard SMILES
CC1CCC2(CC1)Cn1cc([N+](=O)[O-])nc1O2- InChIKey
WVNULYYTNZHAKU-UHFFFAOYSA-N- Molecular formula
- C11H15N3O3
- Average molar mass
- 237.25 g/mol
- Monoisotopic mass
- 237.11134135
Names & identifiers
- Preferred name
- Spiro(cyclohexane-1,2'(3'H)-imidazo(2,1-b)oxazole), 4-methyl-6'-nitro-
- IUPAC
- 4'-methyl-6-nitrospiro[3H-imidazo[2,1-b][1,3]oxazole-2,1'-cyclohexane]
Names & synonyms
127692-25-5Spiro(cyclohexane-1,2'(3'H)-imidazo(2,1-b)oxazole), 4-methyl-6'-nitro-Spiro[cyclohexane-1,2'(3'H)-imidazo[2,1-b]oxazole], 4-methyl-6'-nitro-DTXSID401556294'-methyl-6-nitro-spiro[3H-imidazo[2,1-b]oxazole-2,1'-cyclohexane]4-METHYL-6'-NITRO-3'H-SPIRO[CYCLOHEXANE-1,2'-IMIDAZO[2,1-B][1,3]OXAZOLE]
Database identifiers
- CAS
127692-25-5- PubChem CID
- 460740
- DTXSID
DTXSID40155629
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 322
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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