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2-Hydroxy-3-bromo-5-(1,1-dimethylethyl)benzaldehyde oxime

HCID 136364584
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)(C)c1cc(Br)c(O)c(C=NO)c1
InChIKey
APODRJPJFDBJAC-UHFFFAOYSA-N
Molecular formula
C11H14BrNO2
Average molar mass
272.14 g/mol
Monoisotopic mass
271.02079

Names & identifiers

Preferred name
2-Hydroxy-3-bromo-5-(1,1-dimethylethyl)benzaldehyde oxime
IUPAC
2-bromo-4-tert-butyl-6-(hydroxyiminomethyl)phenol

Names & synonyms

SCHEMBL10394493APODRJPJFDBJAC-UHFFFAOYSA-N2-hydroxy-3-bromo-5-(1,1-dimethylethyl)benzaldehyde oxime

Database identifiers

PubChem CID
136364584

Properties

Computed structural propertiesFilling in

XLogP
3.6
Topological polar surface area
52.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Formal charge
0
Complexity
237

Related reactions

6 records
New reaction record
HRID 195390 reaction equation
HRID 195390As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 1164834 reaction equation
HRID 1164834As productuspto-grants-1990_03
HRID 1164835 reaction equation
HRID 1164835As reactantuspto-grants-1990_03
HRID 1709998 reaction equation
HRID 1709998As productuspto-grants-1990_08
HRID 1709999 reaction equation
HRID 1709999As reactantuspto-grants-1990_08
HRID 2339792 reaction equation
HRID 2339792As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes