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2-Fluoro-pyridine-3-sulphonyl chloride

CAT: 0926-PTB33070-01Size: 0.5 gDry Ice: NoHazardous: No
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CAT#:0926-PTB33070-01Size:0.5 g
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CAS Number
1089330-70-0
MDL Number
MFCD11227180
Smiles
C1=CC (=C (N=C1) F) S (=O) (=O) Cl
Molecular Formula
C5H3ClFNO2S
Molecular Weight
195.6 g/mol
Controlled
No

Chemical Information

2-Fluoropyridine-3-sulfonyl chloride
CAS Number1089330-70-0
PubChem CID55274180
IUPAC Name2-fluoropyridine-3-sulfonyl chloride
Molecular FormulaC5H3ClFNO2S
Molecular Weight195.60
XLogP1.3
Topological Polar Surface Area55.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity225
SMILES
C1=CC(=C(N=C1)F)S(=O)(=O)Cl
InChI
InChI=1S/C5H3ClFNO2S/c6-11(9,10)4-2-1-3-8-5(4)7/h1-3H
InChIKey
MSOAVTSXBMHOEM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Fluoropyridine-3-sulfonyl chloride
CAS: 1089330-70-0
CID: 55274180
Formula: C5H3ClFNO2S
MW: 195.60
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight195.60
XLogP31.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass194.9557054
Monoisotopic Mass194.9557054
Topological Polar Surface Area55.4 Ų
Heavy Atom Count11
Formal Charge0
Complexity225
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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Alternative Products

CatalogName
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