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(2-cyanoethyl)(dimethylsulfamoyl)methylamine

CAS No.:
850802-71-0
Catalog Number:
AG01A9RK
Molecular Formula:
C6H13N3O2S
Molecular Weight:
191.2513
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Product Description
Catalog Number:
AG01A9RK
Chemical Name:
(2-cyanoethyl)(dimethylsulfamoyl)methylamine
CAS Number:
850802-71-0
Molecular Formula:
C6H13N3O2S
Molecular Weight:
191.2513
MDL Number:
MFCD05695648
IUPAC Name:
3-[dimethylsulfamoyl(methyl)amino]propanenitrile
InChI:
InChI=1S/C6H13N3O2S/c1-8(2)12(10,11)9(3)6-4-5-7/h4,6H2,1-3H3
InChI Key:
DHPGSEUWTGMTSM-UHFFFAOYSA-N
SMILES:
CN(S(=O)(=O)N(C)C)CCC#N
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.073g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.249g/mol
Monoisotopic Mass:
191.073g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
72.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  
Properties