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Dimethyl-[(3-phenoxyphenyl)methylidene]azanium (HCID 21985376)|Huagongshe
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Compound
Dimethyl-[(3-phenoxyphenyl)methylidene]azanium
HCID
21985376
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Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
C[N+](C)=Cc1cccc(Oc2ccccc2)c1
InChIKey
VVAGSLDGUYHPMT-UHFFFAOYSA-N
Molecular formula
C15H16NO+
Average molar mass
226.29 g/mol
Names & identifiers
Preferred name
Dimethyl-[(3-phenoxyphenyl)methylidene]azanium
IUPAC
dimethyl-[(3-phenoxyphenyl)methylidene]azanium
Database identifiers
PubChem CID
21985376
Properties
Computed structural properties
XLogP
3.5
Topological polar surface area
12.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
17
Formal charge
1
Complexity
252
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Related reactions
6 records
New reaction record
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
122287
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID
290164
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID
304591
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID
1120800
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID
1537569
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID
1546127
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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Compound notes
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