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Basic information
- Standard SMILES
COC(=O)C(C)(C)Cc1cc(C)c(C2OCCO2)c(C)c1- InChIKey
DRLIONAPSPTGPU-UHFFFAOYSA-N- Molecular formula
- C17H24O4
- Average molar mass
- 292.4 g/mol
Names & identifiers
- Preferred name
- 3-(4-[1,3]Dioxolan-2-yl-3,5-dimethylphenyl)-2,2-dimethylpropionic acid methyl ester
- IUPAC
- methyl 3-[4-(1,3-dioxolan-2-yl)-3,5-dimethylphenyl]-2,2-dimethylpropanoate
Names & synonyms
SCHEMBL1250463DRLIONAPSPTGPU-UHFFFAOYSA-N3-(4-[1,3]dioxolan-2-yl-3,5-dimethylphenyl)-2,2-dimethylpropionic acid methyl ester
Database identifiers
- PubChem CID
- 66965663
Properties
Computed structural propertiesFilling in
- XLogP
- 3.1
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 348
Related reactions
4 records
Compound notes
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