4,4-Dimethyl-3-methylideneoxan-2-one
Basic information
- CAS
57741-67-0- Standard SMILES
C=C1C(=O)OCCC1(C)C- InChIKey
CAUZAEZFDOSPQM-UHFFFAOYSA-N- Molecular formula
- C8H12O2
- Average molar mass
- 140.18 g/mol
- Monoisotopic mass
- 140.08372962
Names & identifiers
- Preferred name
- 4,4-Dimethyl-3-methylideneoxan-2-one
- IUPAC
- 4,4-dimethyl-3-methylideneoxan-2-one
Names & synonyms
57741-67-04,4-dimethyl-3-methylideneoxan-2-oneNSC221575SCHEMBL12514056DTXSID50310020NSC-221575
Database identifiers
- CAS
57741-67-0- PubChem CID
- 312237
- DTXSID
DTXSID50310020
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 180
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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