6,6-Dimethyl-1-propan-2-yl-2-oxabicyclo[3.1.0]hexan-3-one
Basic information
- CAS
756492-07-6- Standard SMILES
CC(C)C12OC(=O)CC1C2(C)C- InChIKey
ASMFHDOUMMGWLF-UHFFFAOYSA-N- Molecular formula
- C10H16O2
- Average molar mass
- 168.23 g/mol
- Monoisotopic mass
- 168.11502975
Names & identifiers
- Preferred name
- 6,6-Dimethyl-1-propan-2-yl-2-oxabicyclo[3.1.0]hexan-3-one
- IUPAC
- 6,6-dimethyl-1-propan-2-yl-2-oxabicyclo[3.1.0]hexan-3-one
- English name
- 2-Oxabicyclo[3.1.0]hexan-3-one,6,6-dimethyl-1-(1-methylethyl)-(9CI)
- Molecular formula
- C10H16O2
- Molecular weight
- 168.23284
Names & synonyms
2-Oxabicyclo[3.1.0]hexan-3-one,6,6-dimethyl-1-(1-methylethyl)-(9CI)
Database identifiers
- CAS
756492-07-6- PubChem CID
- 45096371
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 242
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Compound notes
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