Ethanone, 1-tricyclo[3.2.1.02,7]oct-3-en-1-yl-, stereoisomer (9CI)
Basic information
- CAS
116195-05-2- Standard SMILES
CC(=O)C12CC3C=CC1C2C3- InChIKey
FOWUMYNNQUIXDN-UHFFFAOYSA-N- Molecular formula
- C10H12O
- Average molar mass
- 148.2 g/mol
Names & identifiers
- Preferred name
- Ethanone, 1-tricyclo[3.2.1.02,7]oct-3-en-1-yl-, stereoisomer (9CI)
- IUPAC
- 1-(1-tricyclo[3.2.1.02,7]oct-3-enyl)ethanone
- English name
- Ethanone, 1-tricyclo[3.2.1.02,7]oct-3-en-1-yl-, stereoisomer (9CI)
- Molecular formula
- C10H12O
- Molecular weight
- 148.2
Names & synonyms
116195-05-2Ethanone, 1-tricyclo[3.2.1.02,7]oct-3-en-1-yl-, stereoisomer (9CI)1-(1-tricyclo[3.2.1.02,7]oct-3-enyl)ethanone
Database identifiers
- CAS
116195-05-2
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 266
Physicochemical properties
- Boiling point
- 215.7 · 215.7±29.0 °C(Predicted)
- Density
- 1.202 · 1.202±0.06 g/cm3(Predicted)
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Compound notes
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