Basic information
- Standard SMILES
CN(C)CC(c1ccc(OCOC(=O)C(C)(C)C)cc1)C1(O)CCCCC1- InChIKey
USFWTSABDVJFSJ-UHFFFAOYSA-N- Molecular formula
- C22H35NO4
- Average molar mass
- 377.5 g/mol
Names & identifiers
- Preferred name
- {4-[2-(Dimethylamino)-1-(1-hydroxy cyclohexyl)ethyl]phenoxy}methyl pivalate
- IUPAC
- [4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenoxy]methyl 2,2-dimethylpropanoate
Names & synonyms
SCHEMBL5366968USFWTSABDVJFSJ-UHFFFAOYSA-N{4-[2-(Dimethylamino)-1-(1-hydroxy cyclohexyl)ethyl]phenoxy}methyl pivalate
Database identifiers
- PubChem CID
- 9821087
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 457
Related reactions
4 records
Compound notes
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