3,4-Difluoro-benzoylpropionic acid

HCID 70437117
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Basic information

Standard SMILES
CC(C(=O)O)C(=O)c1ccc(F)c(F)c1
InChIKey
YUVOSBVRAMZYQC-UHFFFAOYSA-N
Molecular formula
C10H8F2O3
Average molar mass
214.16 g/mol

Names & identifiers

Preferred name
3,4-Difluoro-benzoylpropionic acid
IUPAC
3-(3,4-difluorophenyl)-2-methyl-3-oxopropanoic acid

Names & synonyms

SCHEMBL10762807YUVOSBVRAMZYQC-UHFFFAOYSA-N3,4-difluoro-benzoylpropionic acid

Database identifiers

PubChem CID
70437117

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
54.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
15

Related reactions

3 records
New reaction record

Linked notes

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