1,2,3-Thiadiazole, 4-(4-nitrophenyl)-


Chemical Name: 1,2,3-Thiadiazole, 4-(4-nitrophenyl)-
CAS Number: 82894-98-2
Product Number: AG003K4S(AGN-PC-0JSWL5)
Synonyms:
MDL No:
Molecular Formula: C8H5N3O2S
Molecular Weight: 207.2092

Identification/Properties


Properties
MP:
207-211℃ (lit.)
BP:
378.3°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
207.207g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
207.01g/mol
Monoisotopic Mass:
207.01g/mol
Topological Polar Surface Area:
99.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
213
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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