Home Sulfos 3-(methanesulfonylmethyl)-2,5-dihydro-1,2,4-oxadiazol-5-imine

3-(methanesulfonylmethyl)-2,5-dihydro-1,2,4-oxadiazol-5-imine

CAS No.:
1247150-54-4
Catalog Number:
AG01AJMP
Molecular Formula:
C4H7N3O3S
Molecular Weight:
177.1817
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Product Description
Catalog Number:
AG01AJMP
Chemical Name:
3-(methanesulfonylmethyl)-2,5-dihydro-1,2,4-oxadiazol-5-imine
CAS Number:
1247150-54-4
Molecular Formula:
C4H7N3O3S
Molecular Weight:
177.1817
MDL Number:
MFCD28155399
IUPAC Name:
3-(methylsulfonylmethyl)-1,2,4-oxadiazol-5-amine
InChI:
InChI=1S/C4H7N3O3S/c1-11(8,9)2-3-6-4(5)10-7-3/h2H2,1H3,(H2,5,6,7)
InChI Key:
YAPLQMGYGHPORP-UHFFFAOYSA-N
SMILES:
N=c1nc([nH]o1)CS(=O)(=O)C
Properties
Complexity:
221  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.021g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
177.178g/mol
Monoisotopic Mass:
177.021g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1  
Properties