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Pyridine-2-sulfonamide

CAT: 0926-NCA63689-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0926-NCA63689-01Size:1 g
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CAS Number
63636-89-5
MDL Number
MFCD09260336
Smiles
C1=CC=NC (=C1) S (=O) (=O) N
Molecular Formula
C5H6N2O2S
Molecular Weight
158.18 g/mol
Controlled
No

Chemical Information

Pyridine sulfonamide

structure in first source

CAS Number63636-89-5
PubChem CID12000791
IUPAC Namepyridine-2-sulfonamide
Molecular FormulaC5H6N2O2S
Molecular Weight158.18
XLogP-0.3
Topological Polar Surface Area81.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity194
SMILES
C1=CC=NC(=C1)S(=O)(=O)N
InChI
InChI=1S/C5H6N2O2S/c6-10(8,9)5-3-1-2-4-7-5/h1-4H,(H2,6,8,9)
InChIKey
DWJMBQYORXLGAE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pyridine sulfonamide
CAS: 63636-89-5
CID: 12000791
Formula: C5H6N2O2S
MW: 158.18
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight158.18
XLogP3-0.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass158.01499861
Monoisotopic Mass158.01499861
Topological Polar Surface Area81.4 Ų
Heavy Atom Count10
Formal Charge0
Complexity194
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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