Home Sulfos 3-[(chlorosulfonyl)(ethyl)amino]-2-methylpropanenitrile

3-[(chlorosulfonyl)(ethyl)amino]-2-methylpropanenitrile

CAS No.:
1247700-03-3
Catalog Number:
AG01B8T1
Molecular Formula:
C6H11ClN2O2S
Molecular Weight:
210.6817
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Product Description
Catalog Number:
AG01B8T1
Chemical Name:
3-[(chlorosulfonyl)(ethyl)amino]-2-methylpropanenitrile
CAS Number:
1247700-03-3
Molecular Formula:
C6H11ClN2O2S
Molecular Weight:
210.6817
MDL Number:
MFCD16090168
IUPAC Name:
N-(2-cyanopropyl)-N-ethylsulfamoyl chloride
InChI:
InChI=1S/C6H11ClN2O2S/c1-3-9(12(7,10)11)5-6(2)4-8/h6H,3,5H2,1-2H3
InChI Key:
APHSMVKMTBLCAZ-UHFFFAOYSA-N
SMILES:
CCN(S(=O)(=O)Cl)CC(C#N)C
Properties
Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.023g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.676g/mol
Monoisotopic Mass:
210.023g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties