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Compound
1-(Phenoxymethyl)-2-sulfamoylbenzene
HCID
66915467
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
NS(=O)(=O)c1ccccc1COc1ccccc1
InChIKey
SSBZUPYYEALMCX-UHFFFAOYSA-N
Molecular formula
C13H13NO3S
Average molar mass
263.31 g/mol
Names & identifiers
Preferred name
1-(Phenoxymethyl)-2-sulfamoylbenzene
IUPAC
2-(phenoxymethyl)benzenesulfonamide
Names & synonyms
SCHEMBL1128972
SSBZUPYYEALMCX-UHFFFAOYSA-N
1-(phenoxymethyl)-2-sulfamoylbenzene
Database identifiers
PubChem CID
66915467
Properties
Computed structural properties
XLogP
2
Topological polar surface area
77.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
18
Formal charge
0
Complexity
344
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Related reactions
3 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
292871
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID
553468
As product
uspto-grants-2011_11
HRID
553469
As reactant
uspto-grants-2011_11
Compound notes
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