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4-Chlorobenzenesulfonamide

CAT: 0013-GTR19250583-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19250583-01Size:1 g
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Description
4-Chlorobenzenesulfonamide
CAS Number
98-64-6
Smiles
NS (=O) (=O) c1ccc (Cl) cc1
Molecular Formula
C6H6ClNO2S
Molecular Weight
191.63
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

4-Chlorobenzenesulfonamide

4-chlorobenzenesulfonamide is a sulfonamide.

CAS Number98-64-6
PubChem CID66824
IUPAC Name4-chlorobenzenesulfonamide
Molecular FormulaC6H6ClNO2S
Molecular Weight191.64
XLogP1.2
Topological Polar Surface Area68.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity213
SMILES
C1=CC(=CC=C1S(=O)(=O)N)Cl
InChI
InChI=1S/C6H6ClNO2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,(H2,8,9,10)
InChIKey
HHHDJHHNEURCNV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Chlorobenzenesulfonamide
CAS: 98-64-6
CID: 66824
Formula: C6H6ClNO2S
MW: 191.64
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight191.64
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass190.9807773
Monoisotopic Mass190.9807773
Topological Polar Surface Area68.5 Ų
Heavy Atom Count11
Formal Charge0
Complexity213
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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