Basic information
- Standard SMILES
COc1ccc(C(=O)OCC(COC(=O)c2ccc(OC)cc2OC)(COC(=O)c2ccc(OC)cc2OC)COC(=O)c2ccc(OC)cc2OC)c(OC)c1- InChIKey
BFLVWRNBYDKWND-UHFFFAOYSA-N- Molecular formula
- C41H44O16
- Average molar mass
- 792.8 g/mol
Names & identifiers
- Preferred name
- Pentaerythritol Tetrakis(2,4-dimethoxybenzoate)
- IUPAC
- [3-(2,4-dimethoxybenzoyl)oxy-2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]propyl] 2,4-dimethoxybenzoate
Names & synonyms
SCHEMBL11229791BFLVWRNBYDKWND-UHFFFAOYSA-NPentaerythritol Tetrakis(2,4-dimethoxybenzoate)
Database identifiers
- PubChem CID
- 20530744
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 179 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 16
- Rotatable bonds
- 24
- Heavy atoms
- 57
- Formal charge
- 0
- Complexity
- 1,070
Related reactions
1 records
Compound notes
Loading…