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Acenaphthene-1,2-dicarboximide (HCID 21491653)|Huagongshe
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Compound
Acenaphthene-1,2-dicarboximide
HCID
21491653
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Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
Substructure search
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Basic information
Standard SMILES
O=C1NC(=O)C2c3cccc4cccc(c34)C12
InChIKey
UPPWKYOUKJEEFL-UHFFFAOYSA-N
Molecular formula
C14H9NO2
Average molar mass
223.23 g/mol
Names & identifiers
Preferred name
Acenaphthene-1,2-dicarboximide
IUPAC
6b,9a-dihydroacenaphthyleno[1,2-c]pyrrole-7,9-dione
Names & synonyms
acenaphthene-1,2-dicarboximide
SCHEMBL11859432
UPPWKYOUKJEEFL-UHFFFAOYSA-N
Database identifiers
PubChem CID
21491653
Properties
Computed structural properties
XLogP
1.7
Topological polar surface area
46.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
17
Formal charge
0
Complexity
358
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Related reactions
4 records
New reaction record
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
159477
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID
1200773
As product
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID
1973447
As product
uspto-grants-1976_12
HRID
1973448
As reactant
uspto-grants-1976_12
Compound notes
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