4-Bromo-3-chloro-3,4,4-trifluorobutanoic acid

HCID 10912127
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Basic information

Standard SMILES
O=C(O)CC(F)(Cl)C(F)(F)Br
InChIKey
HYQHURUGBWMJHH-UHFFFAOYSA-N
Molecular formula
C4H3BrClF3O2
Average molar mass
255.42 g/mol

Names & identifiers

Preferred name
4-Bromo-3-chloro-3,4,4-trifluorobutanoic acid
IUPAC
4-bromo-3-chloro-3,4,4-trifluorobutanoic acid

Names & synonyms

4-bromo-3-chloro-3,4,4-trifluorobutanoic acidSCHEMBL83444014-bromo-3-chloro-3,4,4-trifiuorobutanoic acid

Database identifiers

PubChem CID
10912127

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
11

Related reactions

40 records
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Linked notes

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