Home Halogens 1,2,4-Oxadiazole, 3-(chloromethyl)-5-(2-thienyl)-

1,2,4-Oxadiazole, 3-(chloromethyl)-5-(2-thienyl)-

CAS No.:
306936-06-1
Catalog Number:
AG0030X6
Molecular Formula:
C7H5ClN2OS
Molecular Weight:
200.6454
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Product Description
Catalog Number:
AG0030X6
Chemical Name:
1,2,4-Oxadiazole, 3-(chloromethyl)-5-(2-thienyl)-
CAS Number:
306936-06-1
Molecular Formula:
C7H5ClN2OS
Molecular Weight:
200.6454
MDL Number:
MFCD01571188
IUPAC Name:
3-(chloromethyl)-5-thiophen-2-yl-1,2,4-oxadiazole
InChI:
InChI=1S/C7H5ClN2OS/c8-4-6-9-7(11-10-6)5-2-1-3-12-5/h1-3H,4H2
InChI Key:
YVYZVJRSESVBCM-UHFFFAOYSA-N
SMILES:
ClCc1noc(n1)c1cccs1
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.981g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.64g/mol
Monoisotopic Mass:
199.981g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties