Lithium 3-ethoxycarbonyl-2-methyl-3-oxo-1-(4-trifluoromethyl-phenyl)-propan-1-olate

HCID 89907367
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Basic information

Standard SMILES
CCOC(=O)C(=O)C(C)C([O-])c1ccc(C(F)(F)F)cc1.[Li+]
InChIKey
XFRCMRIKLFAEQE-UHFFFAOYSA-N
Molecular formula
C14H14F3LiO4
Average molar mass
310.2 g/mol

Names & identifiers

Preferred name
Lithium 3-ethoxycarbonyl-2-methyl-3-oxo-1-(4-trifluoromethyl-phenyl)-propan-1-olate
IUPAC
lithium 4-ethoxy-2-methyl-3,4-dioxo-1-[4-(trifluoromethyl)phenyl]butan-1-olate

Names & synonyms

Lithium 3-ethoxycarbonyl-2-methyl-3-oxo-1-(4-trifluoromethyl-phenyl)-propan-1-olateSCHEMBL15392338

Database identifiers

PubChem CID
89907367

Properties

Computed structural properties

Topological polar surface area
66.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
22

Related reactions

4 records
New reaction record

Linked notes

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