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


Chemical Name: 1,3,4-Thiadiazol-2-amine, 5-(ethylthio)-
CAS Number: 25660-70-2
Product Number: AG003GGY(AGN-PC-0JLCTL)
Synonyms:
MDL No:
Molecular Formula: C4H7N3S2
Molecular Weight: 161.2485

Identification/Properties


Properties
MP:
135-137 °C(lit.)
BP:
322.2°C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Refractive Index:
1.5800 (estimate)
Computed Properties
Molecular Weight:
161.241g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
161.008g/mol
Monoisotopic Mass:
161.008g/mol
Topological Polar Surface Area:
105A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
89.9
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-H335
Precautionary Statements:
P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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