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Chroman-4-one O-methyl-oxime (HCID 54035320)|Huagongshe
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Compound
Chroman-4-one O-methyl-oxime
HCID
54035320
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
CON=C1CCOc2ccccc21
InChIKey
XZEUKAQVXWQODP-UHFFFAOYSA-N
Molecular formula
C10H11NO2
Average molar mass
177.2 g/mol
Names & identifiers
Preferred name
Chroman-4-one O-methyl-oxime
IUPAC
N-methoxy-2,3-dihydrochromen-4-imine
Names & synonyms
Chroman-4-one O-methyl-oxime
SCHEMBL9411057
SCHEMBL9411160
SCHEMBL17146135
XZEUKAQVXWQODP-UHFFFAOYSA-N
Database identifiers
PubChem CID
54035320
Properties
Computed structural properties
XLogP
2
Topological polar surface area
30.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
13
Formal charge
0
Complexity
203
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Related reactions
5 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
1158801
As product
uspto-grants-2010_10
HRID
1158802
As reactant
uspto-grants-2010_10
HRID
1231501
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID
2092163
As product
uspto-grants-2013_05
HRID
2092164
As reactant
uspto-grants-2013_05
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Compound notes
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