1,2,3-Thiadiazole, 5-methyl-4-phenyl-


Chemical Name: 1,2,3-Thiadiazole, 5-methyl-4-phenyl-
CAS Number: 64273-28-5
Product Number: AG00EBLB(AGN-PC-0JMC2V)
Synonyms:
MDL No:
Molecular Formula: C9H8N2S
Molecular Weight: 176.2382

Identification/Properties


Computed Properties
Molecular Weight:
176.237g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
176.041g/mol
Monoisotopic Mass:
176.041g/mol
Topological Polar Surface Area:
54A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
146
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


NMR Spectrum


Other Analytical Data


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