2-[(1,1,3,3-Tetramethyl-1,3-dihydro-2H-isoindol-2-yl)oxy]butan-1-ol
Basic information
- CAS
89482-48-4- Standard SMILES
CCC(CO)ON1C(C)(C)c2ccccc2C1(C)C- InChIKey
ATKCZRWIZLYOAI-UHFFFAOYSA-N- Molecular formula
- C16H25NO2
- Average molar mass
- 263.37 g/mol
- Monoisotopic mass
- 263.18852904
Names & identifiers
- Preferred name
- 2-[(1,1,3,3-Tetramethyl-1,3-dihydro-2H-isoindol-2-yl)oxy]butan-1-ol
- IUPAC
- 2-(1,1,3,3-tetramethylisoindol-2-yl)oxybutan-1-ol
Names & synonyms
89482-48-4DTXSID705330372-[(1,1,3,3-Tetramethyl-1,3-dihydro-2H-isoindol-2-yl)oxy]butan-1-ol
Database identifiers
- CAS
89482-48-4- PubChem CID
- 13264697
- DTXSID
DTXSID70533037
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 290
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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