Basic information
- Standard SMILES
C[C@@H]1CC2(CC[C@H]1N)OCCO2- InChIKey
PDOORKUEGZDAJL-HTQZYQBOSA-N- Molecular formula
- C9H17NO2
- Average molar mass
- 171.24 g/mol
- Monoisotopic mass
- 171.12592879
Names & identifiers
- Preferred name
- (7R,8R)-7-Methyl-1,4-dioxaspiro[4.5]decan-8-amine
- IUPAC
- (7R,8R)-7-methyl-1,4-dioxaspiro[4.5]decan-8-amine
Names & synonyms
(7R,8R)-7-Methyl-1,4-dioxaspiro[4.5]decan-8-amine1160756-90-0SCHEMBL3506631PDOORKUEGZDAJL-HTQZYQBOSA-N
Database identifiers
- PubChem CID
- 59543149
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 44.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 166
Related reactions
3 records
Compound notes
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