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N-(o-(o-Fluorobenzoyl)phenyl)-p-toluenesulphonamide

HCID 76556
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
3109-35-1
Standard SMILES
Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)c2ccccc2F)cc1
InChIKey
ZNDPAUWIWUGTNC-UHFFFAOYSA-N
Molecular formula
C20H16FNO3S
Average molar mass
369.4 g/mol
Monoisotopic mass
369.08349271

Names & identifiers

Preferred name
N-(o-(o-Fluorobenzoyl)phenyl)-p-toluenesulphonamide
IUPAC
N-[2-(2-fluorobenzoyl)phenyl]-4-methylbenzenesulfonamide
English name
N-[o-(o-fluorobenzoyl)phenyl]-p-toluenesulphonamide
Molecular formula
C20H16FNO3S
Molecular weight
369.41

Names & synonyms

3109-35-1N-(o-(o-Fluorobenzoyl)phenyl)-p-toluenesulphonamideEINECS 221-471-0DTXSID50953193ZNDPAUWIWUGTNC-UHFFFAOYSA-NN-[2-(2-Fluorobenzoyl)phenyl]-4-methylbenzene-1-sulfonamideNS00045987N-[o-(o-fluorobenzoyl)phenyl]-p-toluenesulphonamideN-[2-(2-Fluorobenzoyl)phenyl]-4-methylbenzenesulfonamideBenzenesulfonamide, N-[2-(2-fluorobenzoyl)phenyl]-4-methyl-

Database identifiers

CAS
3109-35-1
PubChem CID
76556
DTXSID
DTXSID50953193
EC Number
221-471-0
Nikkaji
J217.276C

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
71.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
26
Formal charge
0
Complexity
580

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Compound notes

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