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


Chemical Name: 1,3,4-Thiadiazol-2-amine, 5-(2-chlorophenyl)-
CAS Number: 828-81-9
Product Number: AG004WFG(AGN-PC-0JSSRA)
Synonyms:
MDL No:
Molecular Formula: C8H6ClN3S
Molecular Weight: 211.6713

Identification/Properties


Properties
MP:
192-195°C
BP:
393.8°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
211.667g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
210.997g/mol
Monoisotopic Mass:
210.997g/mol
Topological Polar Surface Area:
80A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
181
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:
H302-H315-H319-H332-H335
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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