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N- (4-chlorophenyl) methanesulfonamide

CAT: 0013-GTR19252112-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19252112-01Size:100 mg
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Description
N- (4-chlorophenyl) methanesulfonamide
CAS Number
4284-51-9
Smiles
CS (=O) (=O) Nc1ccc (Cl) cc1
Molecular Formula
C7H8ClNO2S
Molecular Weight
205.66
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-(4-Chlorophenyl)methanesulfonamide

N-(4-chlorophenyl)methanesulfonamide is a sulfonamide.

CAS Number4284-51-9
PubChem CID706838
IUPAC NameN-(4-chlorophenyl)methanesulfonamide
Molecular FormulaC7H8ClNO2S
Molecular Weight205.66
XLogP1.8
Topological Polar Surface Area54.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity226
SMILES
CS(=O)(=O)NC1=CC=C(C=C1)Cl
InChI
InChI=1S/C7H8ClNO2S/c1-12(10,11)9-7-4-2-6(8)3-5-7/h2-5,9H,1H3
InChIKey
TZBQEYJPVLKASB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(4-Chlorophenyl)methanesulfonamide
CAS: 4284-51-9
CID: 706838
Formula: C7H8ClNO2S
MW: 205.66
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight205.66
XLogP31.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass204.9964274
Monoisotopic Mass204.9964274
Topological Polar Surface Area54.6 Ų
Heavy Atom Count12
Formal Charge0
Complexity226
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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