Home Halogens Oxazole, 4-(chloromethyl)-5-methyl-2-(2-thienyl)-

Oxazole, 4-(chloromethyl)-5-methyl-2-(2-thienyl)-

CAS No.:
202595-63-9
Catalog Number:
AG0028BA
Molecular Formula:
C9H8ClNOS
Molecular Weight:
213.6839
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Product Description
Catalog Number:
AG0028BA
Chemical Name:
Oxazole, 4-(chloromethyl)-5-methyl-2-(2-thienyl)-
CAS Number:
202595-63-9
Molecular Formula:
C9H8ClNOS
Molecular Weight:
213.6839
MDL Number:
MFCD08691341
IUPAC Name:
4-(chloromethyl)-5-methyl-2-thiophen-2-yl-1,3-oxazole
InChI:
InChI=1S/C9H8ClNOS/c1-6-7(5-10)11-9(12-6)8-3-2-4-13-8/h2-4H,5H2,1H3
InChI Key:
PLUQESCJPNWDFO-UHFFFAOYSA-N
SMILES:
ClCc1nc(oc1C)c1cccs1
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.002g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.679g/mol
Monoisotopic Mass:
213.002g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties