5-Acetoxy-4,6-di-tert-butyl-2-hydroxybenzaldehyde
Basic information
- Standard SMILES
CC(=O)Oc1c(C(C)(C)C)cc(O)c(C=O)c1C(C)(C)C- InChIKey
ZXLSPBINTBCOEN-UHFFFAOYSA-N- Molecular formula
- C17H24O4
- Average molar mass
- 292.4 g/mol
Names & identifiers
- Preferred name
- 5-Acetoxy-4,6-di-tert-butyl-2-hydroxybenzaldehyde
- IUPAC
- (2,6-ditert-butyl-3-formyl-4-hydroxyphenyl) acetate
Names & synonyms
SCHEMBL6307528ZXLSPBINTBCOEN-UHFFFAOYSA-N5-acetoxy-4,6-di-tert-butyl-2-hydroxybenzaldehyde
Database identifiers
- PubChem CID
- 11044545
- Nikkaji
- J2.085.140F
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 389
Related reactions
7 records
Compound notes
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