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Basic information
- Standard SMILES
CC(C)COC(=O)c1cc(OCC(C)C)ccc1OCC(C)C- InChIKey
WYGOYROZQSJHSA-UHFFFAOYSA-N- Molecular formula
- C19H30O4
- Average molar mass
- 322.4 g/mol
Names & identifiers
- Preferred name
- Isobutyl 2,5-diisobutoxybenzoate
- IUPAC
- 2-methylpropyl 2,5-bis(2-methylpropoxy)benzoate
Names & synonyms
SCHEMBL4281903isobutyl 2,5-diisobutoxybenzoateWYGOYROZQSJHSA-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 17816554
Properties
Computed structural propertiesFilling in
- XLogP
- 5.7
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 338
Related reactions
3 records
Compound notes
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