Home Halogens 2-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]-N-methylacetamide

2-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]-N-methylacetamide

CAS No.:
1384430-49-2
Catalog Number:
AG019U1Q
Molecular Formula:
C6H8ClN3O2
Molecular Weight:
189.5996
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Product Description
Catalog Number:
AG019U1Q
Chemical Name:
2-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]-N-methylacetamide
CAS Number:
1384430-49-2
Molecular Formula:
C6H8ClN3O2
Molecular Weight:
189.5996
MDL Number:
MFCD22056520
IUPAC Name:
2-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]-N-methylacetamide
InChI:
InChI=1S/C6H8ClN3O2/c1-8-5(11)2-4-9-6(3-7)12-10-4/h2-3H2,1H3,(H,8,11)
InChI Key:
VPJBFWRJDXFXTR-UHFFFAOYSA-N
SMILES:
CNC(=O)Cc1noc(n1)CCl
Properties
Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.031g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.599g/mol
Monoisotopic Mass:
189.031g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
68A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties