2,7-Dioxaspiro(4.4)nonane-1,6-dione, 3-((diethylamino)methyl)-8-methyl-
Basic information
- CAS
66223-12-9- Standard SMILES
CCN(CC)CC1CC2(CC(C)OC2=O)C(=O)O1- InChIKey
UCYACJBXOQVGNL-UHFFFAOYSA-N- Molecular formula
- C13H21NO4
- Average molar mass
- 255.31 g/mol
- Monoisotopic mass
- 255.14705815
Names & identifiers
- Preferred name
- 2,7-Dioxaspiro(4.4)nonane-1,6-dione, 3-((diethylamino)methyl)-8-methyl-
- IUPAC
- 3-(diethylaminomethyl)-8-methyl-2,7-dioxaspiro[4.4]nonane-1,6-dione
Names & synonyms
3-((Diethylamino)methyl)-8-methyl-2,7-dioxaspiro(4.4)nonane-1,6-dioneDTXSID609847162,7-DIOXASPIRO(4.4)NONANE-1,6-DIONE, 3-((DIETHYLAMINO)METHYL)-8-METHYL-3-[(diethylamino)methyl]-8-methyl-2,7-dioxaspiro[4.4]nonane-1,6-dioneRefChem:248837DTXCID40141192366223-12-9
Database identifiers
- CAS
66223-12-9- PubChem CID
- 47867
- DTXSID
DTXSID60984716
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 353
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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