3-chloro-5-[(4-methylphenyl)methylsulfonyl]-1,2,4-thiadiazole


Chemical Name: 3-chloro-5-[(4-methylphenyl)methylsulfonyl]-1,2,4-thiadiazole
CAS Number: 494763-26-7
Product Number: AG00DD3W(AGN-PC-0JXTMY)
Synonyms:
MDL No:
Molecular Formula: C10H9ClN2O2S2
Molecular Weight: 288.7737

Identification/Properties


Computed Properties
Molecular Weight:
288.764g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
287.979g/mol
Monoisotopic Mass:
287.979g/mol
Topological Polar Surface Area:
96.5A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
350
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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