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79604-49-2

79604-49-2 structural image
Product Name: 2-(2,4-DICHLORO-PHENYL)-5-METHYL-2,4-DIHYDRO-[1,2,4]TRIAZOL-3-ONE
Formula: C9H7Cl2N3O
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COMPUTED DESCRIPTORS

Molecular Weight 244.07 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 242.9966172 g/mol
Monoisotopic Mass 242.9966172 g/mol
Topological Polar Surface Area 44.7 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 308
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