Basic information
- Standard SMILES
C=CCc1c(OCc2ccccc2)cc(C(=O)OC(C)(C)C)cc1OCc1ccccc1- InChIKey
UYQMQKPXFHKNIA-UHFFFAOYSA-N- Molecular formula
- C28H30O4
- Average molar mass
- 430.5 g/mol
Names & identifiers
- Preferred name
- 4-Allyl-3,5-bis-benzyloxy-benzoic acid tert-butyl ester
- IUPAC
- tert-butyl 3,5-bis(phenylmethoxy)-4-prop-2-enylbenzoate
Names & synonyms
SCHEMBL642284UYQMQKPXFHKNIA-UHFFFAOYSA-NDB-405531tert-butyl 4-allyl-3,5-bis(benzyloxy)benzoate4-Allyl-3,5-bis-benzyloxy-benzoic acid tert-butyl ester955885-86-6
Database identifiers
- PubChem CID
- 59560271
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 536
Related reactions
5 records
Compound notes
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