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4-Bromo-2-fluoro-N-hydroxybenzenecarboximidoyl chloride

HCID 73461925
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
ON=C(Cl)c1ccc(Br)cc1F
InChIKey
JNSXQIJPRDYMEI-UHFFFAOYSA-N
Molecular formula
C7H4BrClFNO
Average molar mass
252.47 g/mol

Names & identifiers

Preferred name
4-Bromo-2-fluoro-N-hydroxybenzenecarboximidoyl chloride
IUPAC
4-bromo-2-fluoro-N-hydroxybenzenecarboximidoyl chloride

Names & synonyms

334971-44-74-Bromo-2-fluoro-N-hydroxybenzenecarboximidoyl chloride4-Bromo-2-fluoro-N-hydroxybenZimidoyl chlorideSCHEMBL1135386JNSXQIJPRDYMEI-UHFFFAOYSA-N2-fluoro-4-bromo-benzoyl chloride oximeSY332169DB-086808901309-01-1

Database identifiers

PubChem CID
73461925

Properties

Computed structural propertiesFilling in

XLogP
3.5
Topological polar surface area
32.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
12
Formal charge
0
Complexity
190

Related reactions

6 records
New reaction record
HRID 434048 reaction equation
HRID 434048As productuspto-grants-2003_12
HRID 434049 reaction equation
HRID 434049As reactantuspto-grants-2003_12
HRID 1143946 reaction equation
HRID 1143946As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1203221 reaction equation
HRID 1203221As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1988895 reaction equation
HRID 1988895As productuspto-grants-2010_01
HRID 1988896 reaction equation
HRID 1988896As reactantuspto-grants-2010_01

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes