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2-[4-(2-Methoxyphenyl)butyl]phenol (HCID 19423979)|Huagongshe
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Compound
2-[4-(2-Methoxyphenyl)butyl]phenol
HCID
19423979
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
COc1ccccc1CCCCc1ccccc1O
InChIKey
CDJQMTXRTQIBAY-UHFFFAOYSA-N
Molecular formula
C17H20O2
Average molar mass
256.34 g/mol
Names & identifiers
Preferred name
2-[4-(2-Methoxyphenyl)butyl]phenol
IUPAC
2-[4-(2-methoxyphenyl)butyl]phenol
Names & synonyms
SCHEMBL8704875
CDJQMTXRTQIBAY-UHFFFAOYSA-N
2-[4-(2-methoxyphenyl)butyl]phenol
Database identifiers
PubChem CID
19423979
Properties
Computed structural properties
XLogP
4.8
Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
6
Heavy atoms
19
Formal charge
0
Complexity
241
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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
135376
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID
743196
As reactant
uspto-grants-1996_09
HRID
743208
As reactant
uspto-grants-1996_09
HRID
743387
As product
uspto-grants-1996_09
Compound notes
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