tert-Butyl 4-(2,6-difluorophenyl)-4-oxobutyrate

HCID 21964547
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Basic information

Standard SMILES
CC(C)(C)OC(=O)CCC(=O)c1c(F)cccc1F
InChIKey
RMFVLOPLBXSEBE-UHFFFAOYSA-N
Molecular formula
C14H16F2O3
Average molar mass
270.27 g/mol

Names & identifiers

Preferred name
tert-Butyl 4-(2,6-difluorophenyl)-4-oxobutyrate
IUPAC
tert-butyl 4-(2,6-difluorophenyl)-4-oxobutanoate

Names & synonyms

RMFVLOPLBXSEBE-UHFFFAOYSA-Ntert-Butyl 4-(2,6-difluorophenyl)-4-oxobutyrate

Database identifiers

PubChem CID
21964547

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
43.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
19

Related reactions

32 records
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Compound notes

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