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Compound
Ethyl 4-[2-(2,4-dimethoxyphenyl)-2-oxoethyl]benzoate
HCID
67367690
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Properties
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Basic information
Standard SMILES
CCOC(=O)c1ccc(CC(=O)c2ccc(OC)cc2OC)cc1
InChIKey
UFCKZTGDLDFIQU-UHFFFAOYSA-N
Molecular formula
C19H20O5
Average molar mass
328.4 g/mol
Names & identifiers
Preferred name
Ethyl 4-[2-(2,4-dimethoxyphenyl)-2-oxoethyl]benzoate
IUPAC
ethyl 4-[2-(2,4-dimethoxyphenyl)-2-oxoethyl]benzoate
Names & synonyms
SCHEMBL2334429
DB-113038
1324054-54-7
Database identifiers
PubChem CID
67367690
Properties
Computed structural properties
XLogP
3.4
Topological polar surface area
61.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
8
Heavy atoms
24
Formal charge
0
Complexity
414
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Related reactions
1 records
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As solvent
HRID
813058
As product
Test data from https://doi.org/10.1039/C8SC04228D
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