Basic information
- Standard SMILES
CCCCCC(=O)c1ccc2c(c1)C(C)(C)CCC2(C)C- InChIKey
TWTRBIVJZMWTEQ-UHFFFAOYSA-N- Molecular formula
- C20H30O
- Average molar mass
- 286.5 g/mol
- Monoisotopic mass
- 286.22966558
Names & identifiers
- Preferred name
- 1-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-1-hexanone
- IUPAC
- 1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)hexan-1-one
Names & synonyms
SCHEMBL7143184TWTRBIVJZMWTEQ-UHFFFAOYSA-N1-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-1-hexanone
Database identifiers
- PubChem CID
- 22456876
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 366
Related reactions
2 records
Compound notes
Loading…