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N-Cyclopropylmethanesulfonamide

CAT: 0127-OR1006425-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1006425-01Size:250 mg
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CAS Number
479065-29-7
Purity
95%
Smiles
CS(=O)(NC1CC1)=O

Chemical Information

N-cyclopropylmethanesulfonamide
CAS Number479065-29-7
PubChem CID5112945
IUPAC NameN-cyclopropylmethanesulfonamide
Molecular FormulaC4H9NO2S
Molecular Weight135.19
XLogP-0.1
Topological Polar Surface Area54.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count8
Formal Charge0
Complexity163
SMILES
CS(=O)(=O)NC1CC1
InChI
InChI=1S/C4H9NO2S/c1-8(6,7)5-4-2-3-4/h4-5H,2-3H2,1H3
InChIKey
POEOXZQLWUIFQW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-cyclopropylmethanesulfonamide
CAS: 479065-29-7
CID: 5112945
Formula: C4H9NO2S
MW: 135.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight135.19
XLogP3-0.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass135.03539970
Monoisotopic Mass135.03539970
Topological Polar Surface Area54.6 Ų
Heavy Atom Count8
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