1,2,3-Thiadiazole-4-carboxaldehyde


Chemical Name: 1,2,3-Thiadiazole-4-carboxaldehyde
CAS Number: 27643-15-8
Product Number: AG002UB4(AGN-PC-0KK8EV)
Synonyms:
MDL No:
Molecular Formula: C3H2N2OS
Molecular Weight: 114.1258

Identification/Properties


Properties
MP:
85 °C
BP:
220.597°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
114.122g/mol
XLogP3:
0.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
113.989g/mol
Monoisotopic Mass:
113.989g/mol
Topological Polar Surface Area:
71.1A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
77.3
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:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H317
Precautionary Statements:
P261-P264-P270-P272-P280-P301+P312+P330-P302+P352-P333+P313-P363-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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