Basic information
- Standard SMILES
CN(C)C1CCC2(CC1)OCC(c1ccc(Cl)cc1)O2- InChIKey
ICTXVEUXYDWSJV-UHFFFAOYSA-N- Molecular formula
- C16H22ClNO2
- Average molar mass
- 295.8 g/mol
- Monoisotopic mass
- 295.1339066
Names & identifiers
- Preferred name
- [-(4-Chlorophenyl)-1,4-dioxaspiro[4.5]dec-8-yl]dimethylamine
- IUPAC
- 3-(4-chlorophenyl)-N,N-dimethyl-1,4-dioxaspiro[4.5]decan-8-amine
Names & synonyms
SCHEMBL5402843ICTXVEUXYDWSJV-UHFFFAOYSA-N[-(4-chlorophenyl)-1,4-dioxaspiro[4.5]dec-8-yl]dimethylamine
Database identifiers
- PubChem CID
- 69429048
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 21.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 320
Related reactions
1 records
Compound notes
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