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2-(2-Hydroxyphenoxy)acetonitrile (HCID 21553935)|Huagongshe
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Compound
2-(2-Hydroxyphenoxy)acetonitrile
HCID
21553935
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Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
N#CCOc1ccccc1O
InChIKey
NWKRQZLUPUYDDF-UHFFFAOYSA-N
Molecular formula
C8H7NO2
Average molar mass
149.15 g/mol
Names & identifiers
Preferred name
2-(2-Hydroxyphenoxy)acetonitrile
IUPAC
2-(2-hydroxyphenoxy)acetonitrile
Names & synonyms
SCHEMBL11873912
2-(2-hydroxyphenoxy)acetonitrile
NWKRQZLUPUYDDF-UHFFFAOYSA-N
AKOS009315869
Database identifiers
PubChem CID
21553935
Properties
Computed structural properties
XLogP
1
Topological polar surface area
53.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
11
Formal charge
0
Complexity
161
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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
204729
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID
267791
As product
uspto-grants-1976_03
HRID
267792
As reactant
uspto-grants-1976_03
HRID
2145222
As product
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Compound notes
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