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trans-Dibenzylideneacetone (HCID 5354370)|Huagongshe
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Compound
trans-Dibenzylideneacetone
HCID
5354370
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Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
O=C(C=Cc1ccccc1)/C=C/c1ccccc1
InChIKey
WMKGGPCROCCUDY-AOGCGKDYSA-N
Molecular formula
C17H14O
Average molar mass
234.29 g/mol
Monoisotopic mass
234.10446507
Names & identifiers
Preferred name
trans-Dibenzylideneacetone
IUPAC
(4E)-1,5-diphenylpenta-1,4-dien-3-one
Names & synonyms
trans-dibenzylideneacetone
transdibenzylidenacetone
SCHEMBL478244
WMKGGPCROCCUDY-AOGCGKDYSA-N
Database identifiers
PubChem CID
5354370
Properties
Computed structural properties
XLogP
4.1
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
4
Heavy atoms
18
Formal charge
0
Complexity
272
Show all 8
Show all 8 / 8
Related reactions
4 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
432003
As reactant
uspto-grants-2003_12
HRID
1371848
As reactant
uspto-grants-2007_01
HRID
1666791
As reactant
uspto-grants-2011_10
HRID
2216893
As reactant
uspto-grants-2006_09
Compound notes
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