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7-Hydroxy-4-methyl-1-indanone oxime

HCID 136342837
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1ccc(O)c2c1CCC2=NO
InChIKey
CYNKTGLTMIWWRS-UHFFFAOYSA-N
Molecular formula
C10H11NO2
Average molar mass
177.2 g/mol

Names & identifiers

Preferred name
7-Hydroxy-4-methyl-1-indanone oxime
IUPAC
3-hydroxyimino-7-methyl-1,2-dihydroinden-4-ol

Names & synonyms

7-hydroxy-4-methyl-1-indanone oximeSCHEMBL10664537CYNKTGLTMIWWRS-UHFFFAOYSA-N

Database identifiers

PubChem CID
136342837

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
52.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
13
Formal charge
0
Complexity
227

Related reactions

4 records
New reaction record
HRID 118867 reaction equation
HRID 118867As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 414686 reaction equation
HRID 414686As productuspto-grants-1988_12
HRID 414687 reaction equation
HRID 414687As reactantuspto-grants-1988_12
HRID 838559 reaction equation
HRID 838559As reactantTest data from https://doi.org/10.1039/C8SC04228D

Compound notes

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