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6-Benzyl-1-oxo-6-azaspiro[2.5]octane (HCID 22744576)|Huagongshe
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Compound
6-Benzyl-1-oxo-6-azaspiro[2.5]octane
HCID
22744576
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
O=C1CC12CCN(Cc1ccccc1)CC2
InChIKey
XMHBJWFUTHGDQN-UHFFFAOYSA-N
Molecular formula
C14H17NO
Average molar mass
215.29 g/mol
Names & identifiers
Preferred name
6-Benzyl-1-oxo-6-azaspiro[2.5]octane
IUPAC
6-benzyl-6-azaspiro[2.5]octan-2-one
Names & synonyms
SCHEMBL6777379
XMHBJWFUTHGDQN-UHFFFAOYSA-N
6-benzyl-1-oxo-6-azaspiro[2.5]octane
Database identifiers
PubChem CID
22744576
Properties
Computed structural properties
XLogP
1.6
Topological polar surface area
20.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
272
Show all 8
Show all 8 / 8
Related reactions
3 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
47336
As reactant
uspto-grants-2004_03
HRID
1209593
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID
2300172
As reactant
uspto-grants-2002_12
Compound notes
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