Basic information
- Standard SMILES
CC(=O)CC(=O)OCC(c1ccccc1)c1ccccc1- InChIKey
BZOWXNPUHXXHPO-UHFFFAOYSA-N- Molecular formula
- C18H18O3
- Average molar mass
- 282.3 g/mol
- Monoisotopic mass
- 282.12559443
Names & identifiers
- Preferred name
- 2,2-Diphenylethyl 3-oxobutanoate
- IUPAC
- 2,2-diphenylethyl 3-oxobutanoate
Names & synonyms
2,2-diphenylethyl 3-oxobutanoateDiphenylacetessigester2,2-diphenylethyl acetoacetateSCHEMBL5413373BZOWXNPUHXXHPO-UHFFFAOYSA-NAKOS024381453ST51029095
Database identifiers
- PubChem CID
- 4076505
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 320
Related reactions
1 records
Compound notes
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