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2-Methoxy-4-phenethylpyridine (HCID 57950442)|Huagongshe
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Compound
2-Methoxy-4-phenethylpyridine
HCID
57950442
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
COc1cc(CCc2ccccc2)ccn1
InChIKey
WLRHIBFVUGEUSF-UHFFFAOYSA-N
Molecular formula
C14H15NO
Average molar mass
213.27 g/mol
Names & identifiers
Preferred name
2-Methoxy-4-phenethylpyridine
IUPAC
2-methoxy-4-(2-phenylethyl)pyridine
Names & synonyms
2-Methoxy-4-phenethylpyridine
SCHEMBL2964822
WLRHIBFVUGEUSF-UHFFFAOYSA-N
Database identifiers
PubChem CID
57950442
Properties
Computed structural properties
XLogP
3.4
Topological polar surface area
22.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
189
Show all 8
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Related reactions
8 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
699961
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID
930639
As product
uspto-grants-2016_03
HRID
930640
As reactant
uspto-grants-2016_03
HRID
1020554
As product
uspto-grants-2014_05
HRID
1020555
As reactant
uspto-grants-2014_05
HRID
1547167
As product
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID
2387510
As product
uspto-grants-2012_09
HRID
2387511
As reactant
uspto-grants-2012_09
Show 4 more
Compound notes
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