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1-(Phenoxymethyl)-2-sulfamoylbenzene

HCID 66915467
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound 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

SCHEMBL1128972SSBZUPYYEALMCX-UHFFFAOYSA-N1-(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

Related reactions

3 records
New reaction record
HRID 292871 reaction equation
HRID 292871As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 553468 reaction equation
HRID 553468As productuspto-grants-2011_11
HRID 553469 reaction equation
HRID 553469As reactantuspto-grants-2011_11

Compound notes

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