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N, N-Dimethylethanesulfonamide

CAT: 0127-OR1028761-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0127-OR1028761-01Size:1 g
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CAS Number
6338-68-7
Synonyms
N, N-dimethylethanesulfonamide
Purity
99%
Smiles
CCS(=O)(=O)N(C)C

Chemical Information

N,N-Dimethylethanesulfonamide
CAS Number6338-68-7
PubChem CID80644
IUPAC NameN,N-dimethylethanesulfonamide
Molecular FormulaC4H11NO2S
Molecular Weight137.20
XLogP-0.1
Topological Polar Surface Area45.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count8
Formal Charge0
Complexity142
SMILES
CCS(=O)(=O)N(C)C
InChI
InChI=1S/C4H11NO2S/c1-4-8(6,7)5(2)3/h4H2,1-3H3
InChIKey
MORLSCQKZAPYFM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N,N-Dimethylethanesulfonamide
CAS: 6338-68-7
CID: 80644
Formula: C4H11NO2S
MW: 137.20
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight137.20
XLogP3-0.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass137.05104977
Monoisotopic Mass137.05104977
Topological Polar Surface Area45.8 Ų
Heavy Atom Count8
Formal Charge0
Complexity142
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