1,3,4-Thiadiazol-2-amine, 5-(trifluoromethyl)-


Chemical Name: 1,3,4-Thiadiazol-2-amine, 5-(trifluoromethyl)-
CAS Number: 10444-89-0
Product Number: AG003GHS(AGN-PC-0JLU0I)
Synonyms:
MDL No:
Molecular Formula: C3H2F3N3S
Molecular Weight: 169.1283

Identification/Properties


Properties
MP:
225-227 °C
BP:
182.2±50.0 °C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Solubility:
methanol: soluble0.25g/10 mL, clear, colorless
Computed Properties
Molecular Weight:
169.125g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
0
Exact Mass:
168.992g/mol
Monoisotopic Mass:
168.992g/mol
Topological Polar Surface Area:
80A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
127
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#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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