Methyl 4-(5-(2,2,2-trifluoro-1-hydroxyethyl)thiophen-2-yl)butanoate

HCID 67322971
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Basic information

Standard SMILES
COC(=O)CCCc1ccc(C(O)C(F)(F)F)s1
InChIKey
ARXJCEDGEDBAMX-UHFFFAOYSA-N
Molecular formula
C11H13F3O3S
Average molar mass
282.28 g/mol

Names & identifiers

Preferred name
Methyl 4-(5-(2,2,2-trifluoro-1-hydroxyethyl)thiophen-2-yl)butanoate
IUPAC
methyl 4-[5-(2,2,2-trifluoro-1-hydroxyethyl)thiophen-2-yl]butanoate

Names & synonyms

methyl 4-(5-(2,2,2-trifluoro-1-hydroxyethyl)thiophen-2-yl)butanoateSCHEMBL2223189

Database identifiers

PubChem CID
67322971

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
74.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
18

Related reactions

1 records
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Compound notes

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