2,2-Dichloro-1-(1-oxa-5-azaspiro[5.6]dodecan-5-yl)ethan-1-one
Basic information
- CAS
71526-26-6- Standard SMILES
O=C(C(Cl)Cl)N1CCCOC12CCCCCC2- InChIKey
QPDLPGADMYGJIB-UHFFFAOYSA-N- Molecular formula
- C12H19Cl2NO2
- Average molar mass
- 280.19 g/mol
- Monoisotopic mass
- 279.0792842
Names & identifiers
- Preferred name
- 2,2-Dichloro-1-(1-oxa-5-azaspiro[5.6]dodecan-5-yl)ethan-1-one
- IUPAC
- 2,2-dichloro-1-(1-oxa-5-azaspiro[5.6]dodecan-5-yl)ethanone
Names & synonyms
71526-26-6SCHEMBL9873835DTXSID505348852,2-Dichloro-1-(1-oxa-5-azaspiro[5.6]dodecan-5-yl)ethan-1-one
Database identifiers
- CAS
71526-26-6- PubChem CID
- 13288232
- DTXSID
DTXSID50534885
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 276
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Compound notes
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