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Compound
Ethyl 4-[tert-butyl(dimethyl)silyl]oxy-2-[(4-fluorophenoxy)methyl]cyclopentane-1-carboxylate
HCID
77216951
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Basic information
Standard SMILES
CCOC(=O)C1CC(O[Si](C)(C)C(C)(C)C)CC1COc1ccc(F)cc1
InChIKey
BCXWMGORSRXJRX-UHFFFAOYSA-N
Molecular formula
C21H33FO4Si
Average molar mass
396.6 g/mol
Names & identifiers
Preferred name
Ethyl 4-[tert-butyl(dimethyl)silyl]oxy-2-[(4-fluorophenoxy)methyl]cyclopentane-1-carboxylate
IUPAC
ethyl 4-[tert-butyl(dimethyl)silyl]oxy-2-[(4-fluorophenoxy)methyl]cyclopentane-1-carboxylate
Database identifiers
PubChem CID
77216951
Properties
Computed structural properties
Topological polar surface area
44.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
27
Formal charge
0
Complexity
483
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HRID
2148715
As product
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Compound notes
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