3-methyl-3-propan-2-yl-4,5,6,7-tetrahydro-2H-inden-1-one
Basic information
- CAS
672295-31-7- Standard SMILES
CC(C)C1(C)CC(=O)C2=C1CCCC2- InChIKey
BKKUEXONUWBZBJ-UHFFFAOYSA-N- Molecular formula
- C13H20O
- Average molar mass
- 192.3 g/mol
Names & identifiers
- Preferred name
- 3-methyl-3-propan-2-yl-4,5,6,7-tetrahydro-2H-inden-1-one
- IUPAC
- 3-methyl-3-propan-2-yl-4,5,6,7-tetrahydro-2H-inden-1-one
- English name
- 1H-Inden-1-one,2,3,4,5,6,7-hexahydro-3-methyl-3-(1-methylethyl)-(9CI)
- Molecular formula
- C13H20O
- Molecular weight
- 192.3
Names & synonyms
1H-Inden-1-one, 2,3,4,5,6,7-hexahydro-3-methyl-3-(1-methylethyl)-1H-Inden-1-one,2,3,4,5,6,7-hexahydro-3-methyl-3-(1-methylethyl)-(9CI)
Database identifiers
- CAS
672295-31-7- Nikkaji
- J2.019.045K
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 298
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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