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p-Trifluoromethoxybenzaldehyde oxime

HCID 2777199
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
ON=Cc1ccc(OC(F)(F)F)cc1
InChIKey
SFLMISFBFTUVTD-UHFFFAOYSA-N
Molecular formula
C8H6F3NO2
Average molar mass
205.13 g/mol

Names & identifiers

Preferred name
p-Trifluoromethoxybenzaldehyde oxime
IUPAC
N-[[4-(trifluoromethoxy)phenyl]methylidene]hydroxylamine

Names & synonyms

p-trifluoromethoxybenzaldehyde oxime1133426-65-9Maybridge1_008848SCHEMBL21668034-(trifluoromethoxy)benzaldehydeoximeDB-043041

Database identifiers

PubChem CID
2777199

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
41.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
197

Related reactions

9 records
New reaction record
HRID 689573 reaction equation
HRID 689573As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1189519 reaction equation
HRID 1189519As reactantuspto-grants-2014_03
HRID 1424732 reaction equation
HRID 1424732As reactantuspto-grants-2015_01
HRID 1470819 reaction equation
HRID 1470819As reactantuspto-grants-2015_04
HRID 1475158 reaction equation
HRID 1475158As reactantuspto-grants-2015_04
HRID 1475260 reaction equation
HRID 1475260As reactantuspto-grants-2015_04
HRID 1925430 reaction equation
HRID 1925430As reactantuspto-grants-2012_05
HRID 2276393 reaction equation
HRID 2276393As productuspto-grants-2015_09
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Compound notes

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