Basic information
- CAS
51595-76-7- Standard SMILES
Cc1oc(=O)c(C)c(C)c1C- InChIKey
PWVOLXSMGIMTLK-UHFFFAOYSA-N- Molecular formula
- C9H12O2
- Average molar mass
- 152.19 g/mol
- Monoisotopic mass
- 152.08372962
Names & identifiers
- Preferred name
- 3,4,5,6-Tetramethyl-2H-pyran-2-one
- IUPAC
- 3,4,5,6-tetramethylpyran-2-one
Names & synonyms
3,4,5,6-Tetramethyl-2H-pyran-2-one51595-76-7DTXSID10342246RefChem:270538DTXCID702933262H-Pyran-2-one, 3,4,5,6-tetramethyl-SCHEMBL12019536PWVOLXSMGIMTLK-UHFFFAOYSA-N3,4,5,6-tetramethyl-pyran-2-one3,4,5,6-Tetramethyl-2H-pyran-2-one #
Database identifiers
- CAS
51595-76-7- PubChem CID
- 580102
- DTXSID
DTXSID10342246
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 269
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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