Ethyl 4-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methyl)benzoate

HCID 66939680
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Basic information

Standard SMILES
CCOC(=O)c1ccc(Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)cc1
InChIKey
GITTVDKSZLXPBL-UHFFFAOYSA-N
Molecular formula
C21H17F3O3
Average molar mass
374.4 g/mol
Monoisotopic mass
374.11297889

Names & identifiers

Preferred name
Ethyl 4-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methyl)benzoate
IUPAC
ethyl 4-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methyl]benzoate

Names & synonyms

ethyl 4-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methyl)benzoateSCHEMBL1199282

Database identifiers

PubChem CID
66939680

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
39.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
27

Related reactions

2 records
New reaction record

Compound notes

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