5-Methyl-6-oxabicyclo[3.1.0]hexan-2-one
Basic information
- CAS
17024-44-1- Standard SMILES
CC12CCC(=O)C1O2- InChIKey
NDTORNYEOXLIFZ-UHFFFAOYSA-N- Molecular formula
- C6H8O2
- Average molar mass
- 112.13 g/mol
- Monoisotopic mass
- 112.05242949
Names & identifiers
- Preferred name
- 5-Methyl-6-oxabicyclo[3.1.0]hexan-2-one
- IUPAC
- 5-methyl-6-oxabicyclo[3.1.0]hexan-2-one
Names & synonyms
5-methyl-6-oxabicyclo[3.1.0]hexan-2-one17024-44-1NSC239321SCHEMBL11232924DTXSID80311161NSC-239321EN300-367542G39892Z1513595022
Database identifiers
- CAS
17024-44-1- PubChem CID
- 315201
- DTXSID
DTXSID80311161- Nikkaji
- J27.204C
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 29.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 153
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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