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4-Tolylsulfonamide

CAT: 0572-TRC-T536630-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-T536630-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
70-55-3
Synonyms
Gliclazide Imp. A (EP); Tolbutamide Imp. A (EP); p-Toluenesulfonamide; (4-Methylphenyl)sulfonamide; 4-Methylbenzenesulphonamide; Toluenesulfonamide; Gliclazide Impurity A; Tolbutamide Impurity A
Hazard Statement
Causes skin irritation.
Purity
>95% (HPLC)
Smiles
Cc1ccc(cc1)S(=O)(=O)N
Molecular Formula
C7 H9 N O2 S
Molecular Weight
171.22
InChI
InChI=1S/C7H9NO2S/c1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3,(H2,8,9,10)
Additionnal Information
IUPAC name: 4-methylbenzenesulfonamide
Shipping Conditions
Room Temperature
Storage Conditions
+20°C

Chemical Information

P-Toluenesulfonamide

Toluene-4-sulfonamide is a sulfonamide that is benzenesulfonamide bearing a methyl group at position 4.

CAS Number70-55-3
PubChem CID6269
IUPAC Name4-methylbenzenesulfonamide
Molecular FormulaC7H9NO2S
Molecular Weight171.22
XLogP0.8
Topological Polar Surface Area68.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity209
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N
InChI
InChI=1S/C7H9NO2S/c1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3,(H2,8,9,10)
InChIKey
LMYRWZFENFIFIT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of P-Toluenesulfonamide
CAS: 70-55-3
CID: 6269
Formula: C7H9NO2S
MW: 171.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight171.22
XLogP30.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass171.03539970
Monoisotopic Mass171.03539970
Topological Polar Surface Area68.5 Ų
Heavy Atom Count11
Formal Charge0
Complexity209
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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