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Methanesulfonyl Cyanide

CAT: 0572-TRC-M225470-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-M225470-1GSize:1 g
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CAS Number
24225-08-9
Synonyms
Methanesulfonyl cyanide; Methylsulfonyl cyanide
Hazard Statement
No Data Available
Smiles
CS(=O)(=O)C#N
Molecular Formula
C2 H3 N O2 S
Molecular Weight
105.116
InChI
InChI=1S/C2H3NO2S/c1-6(4,5)2-3/h1H3
Additionnal Information
IUPAC name: methylsulfonylformonitrile

Chemical Information

Methanesulfonyl cyanide
CAS Number24225-08-9
PubChem CID90422
IUPAC Namemethylsulfonylformonitrile
Molecular FormulaC2H3NO2S
Molecular Weight105.12
XLogP-0.3
Topological Polar Surface Area66.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count6
Formal Charge0
Complexity163
SMILES
CS(=O)(=O)C#N
InChI
InChI=1S/C2H3NO2S/c1-6(4,5)2-3/h1H3
InChIKey
QEIOAAJCOKZGDV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methanesulfonyl cyanide
CAS: 24225-08-9
CID: 90422
Formula: C2H3NO2S
MW: 105.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight105.12
XLogP3-0.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass104.98844951
Monoisotopic Mass104.98844951
Topological Polar Surface Area66.3 Ų
Heavy Atom Count6
Formal Charge0
Complexity163
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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