Basic information
- Standard SMILES
CC(C)c1cc(CCC(=O)OCC(C)(C)C2OCC3(CO2)COC(C(C)(C)COC(=O)CCc2cc(C(C)C)c(O)c(C(C)(C)C)c2)OC3)cc(C(C)(C)C)c1O- InChIKey
XYBIAQCPODHGCS-UHFFFAOYSA-N- Molecular formula
- C47H72O10
- Average molar mass
- 797.1 g/mol
Names & identifiers
- Preferred name
- 3,9-Bis[2-[3-(3-tert-butyl-4-hydroxy-5-isopropylphenyl)propionyloxy]-1,1-dimethylethyl]-2,4,8,10-tetraoxaspiro[5.5]undecane
- IUPAC
- [2-[3-[1-[3-(3-tert-butyl-4-hydroxy-5-propan-2-ylphenyl)propanoyloxy]-2-methylpropan-2-yl]-2,4,8,10-tetraoxaspiro[5.5]undecan-9-yl]-2-methylpropyl] 3-(3-tert-butyl-4-hydroxy-5-propan-2-ylphenyl)propanoate
Names & synonyms
3,9-bis[2-[3-(3-tert-butyl-4-hydroxy-5-isopropylphenyl)propionyloxy]-1,1-dimethylethyl]-2,4,8,10-tetraoxaspiro[5.5]undecane3,9-bis{2-[3-(3-tert-butyl-4-hydroxy-5-isopropylphenyl)propionyloxy]-1,1-dimethylethyl}-2,4,8,10-tetraoxaspiro[5.5]undecaneSCHEMBL9820555XYBIAQCPODHGCS-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 20043871
Properties
Computed structural properties
- XLogP
- 10.4
- Topological polar surface area
- 130 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 18
- Heavy atoms
- 57
- Formal charge
- 0
- Complexity
- 1,180
Related reactions
3 records
Compound notes
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