Home Halogens 5-chloro-4-(3-nitrophenyl)-1,2,3-thiadiazole

5-chloro-4-(3-nitrophenyl)-1,2,3-thiadiazole

CAS No.:
1909327-27-0
Catalog Number:
AG01C524
Molecular Formula:
C8H4ClN3O2S
Molecular Weight:
241.6543
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Product Description
Catalog Number:
AG01C524
Chemical Name:
5-chloro-4-(3-nitrophenyl)-1,2,3-thiadiazole
CAS Number:
1909327-27-0
Molecular Formula:
C8H4ClN3O2S
Molecular Weight:
241.6543
MDL Number:
MFCD29907049
IUPAC Name:
5-chloro-4-(3-nitrophenyl)thiadiazole
InChI:
InChI=1S/C8H4ClN3O2S/c9-8-7(10-11-15-8)5-2-1-3-6(4-5)12(13)14/h1-4H
InChI Key:
RAXOVYVBHMOHJK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)c1nnsc1Cl
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.971g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.649g/mol
Monoisotopic Mass:
240.971g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
99.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties