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Compound
Benzyl 3-(4-benzyloxyphenyl)propionate
HCID
14281237
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
O=C(CCc1ccc(OCc2ccccc2)cc1)OCc1ccccc1
InChIKey
SKPALAHGJKKMSG-UHFFFAOYSA-N
Molecular formula
C23H22O3
Average molar mass
346.4 g/mol
Monoisotopic mass
346.15689456
Names & identifiers
Preferred name
Benzyl 3-(4-benzyloxyphenyl)propionate
IUPAC
benzyl 3-(4-phenylmethoxyphenyl)propanoate
Names & synonyms
SCHEMBL7276062
SKPALAHGJKKMSG-UHFFFAOYSA-N
benzyl 3-(4-benzyloxyphenyl)propionate
Database identifiers
PubChem CID
14281237
Properties
Computed structural properties
XLogP
5.1
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
9
Heavy atoms
26
Formal charge
0
Complexity
388
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Related reactions
3 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
820810
As reactant
Test data from https://doi.org/10.1039/C8SC04228D
HRID
867601
As product
uspto-grants-1988_10
HRID
867602
As reactant
uspto-grants-1988_10
Compound notes
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