Basic information
- Standard SMILES
Cc1cc(C(C)C)cc(C)c1C=O- InChIKey
AJQQOAYOYHVFEY-UHFFFAOYSA-N- Molecular formula
- C12H16O
- Average molar mass
- 176.25 g/mol
Names & identifiers
- Preferred name
- 2,6-Dimethyl-4-isopropylbenzaldehyde
- IUPAC
- 2,6-dimethyl-4-propan-2-ylbenzaldehyde
Names & synonyms
SCHEMBL7979463AJQQOAYOYHVFEY-UHFFFAOYSA-N2,6-Dimethyl-4-isopropylbenzaldehyde
Database identifiers
- PubChem CID
- 15480700
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 162
Related reactions
11 records
Compound notes
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