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2-benzyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[c]pyrrole-1,3-dione (HCID 70200520)|Huagongshe
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Compound
2-benzyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[c]pyrrole-1,3-dione
HCID
70200520
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Properties
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Basic information
Standard SMILES
O=C1C2CCCC2C(=O)N1Cc1ccccc1
InChIKey
MIVQUQMOPVQLCZ-UHFFFAOYSA-N
Molecular formula
C14H15NO2
Average molar mass
229.27 g/mol
Names & identifiers
Preferred name
2-benzyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[c]pyrrole-1,3-dione
IUPAC
2-benzyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[c]pyrrole-1,3-dione
Names & synonyms
SCHEMBL7829113
Database identifiers
PubChem CID
70200520
Properties
Computed structural properties
XLogP
1.7
Topological polar surface area
37.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
311
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Related reactions
1 records
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As product
As reagent
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As solvent
HRID
1574942
As product
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Compound notes
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