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p-Sulfamylacetanilide

CAT: 0572-TRC-S699240-5GSize: 5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-S699240-5GSize:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
121-61-9
Synonyms
Acetamide, N-[4-(aminosulfonyl)phenyl]-; Acetanilide, 4'-sulfamoyl- (6CI,7CI,8CI); 4-Acetamidobenzenesulfonamide; 4-Acetylaminobenzenesulfonamide; 4'-Sulfamoylacetanilide; A-319; Acetylsulfanilamide; Benzenesulfonamide, 4-(acetylamino)-; Erytrin; N-(4-Sulfamoylphenyl)acetamide; N-[4-(Aminosulfonyl)phenyl]acetamide; N4-Acetsulfanilamide; N4-Acetylsulfanilamide; NSC 217; NSC 406839; Neotherapol; N'-Acetylsulphanilamide; Sulfanilamide-N4-acetate; p-(Acetylamino)benzenesulfonamide; p-Acetamidobenzenesulfonamide; p-Sulfamoylacetanilide; p-Sulfamylacetanilide; Sulfanilamide-N-acetyl
Hazard Statement
Harmful in contact with skin.
Purity
>95% (HPLC)
Smiles
CC(=O)Nc1ccc(cc1)S(=O)(=O)N
Molecular Formula
C8 H10 N2 O3 S
Molecular Weight
214.24
InChI
InChI=1S/C8H10N2O3S/c1-6(11)10-7-2-4-8(5-3-7)14(9,12)13/h2-5H,1H3,(H,10,11)(H2,9,12,13)
Additionnal Information
IUPAC name: N-(4-sulfamoylphenyl)acetamide
Shipping Conditions
Room Temperature
Storage Conditions
+20°C

Chemical Information

N4-Acetylsulfanilamide
CAS Number121-61-9
PubChem CID8482
IUPAC NameN-(4-sulfamoylphenyl)acetamide
Molecular FormulaC8H10N2O3S
Molecular Weight214.24
XLogP0
Topological Polar Surface Area97.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity299
SMILES
CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N
InChI
InChI=1S/C8H10N2O3S/c1-6(11)10-7-2-4-8(5-3-7)14(9,12)13/h2-5H,1H3,(H,10,11)(H2,9,12,13)
InChIKey
PKOFBDHYTMYVGJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N4-Acetylsulfanilamide
CAS: 121-61-9
CID: 8482
Formula: C8H10N2O3S
MW: 214.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight214.24
XLogP30
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass214.04121336
Monoisotopic Mass214.04121336
Topological Polar Surface Area97.6 Ų
Heavy Atom Count14
Formal Charge0
Complexity299
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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