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64910-34-5

64910-34-5 structural image
Product Name: 5-[(2-CHLOROPHENOXY)METHYL]-4-PHENYL-4H-1,2,4-TRIAZOLE-3-THIOL
Formula: C15H12ClN3OS
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COMPUTED DESCRIPTORS

Molecular Weight 317.8 g/mol
XLogP3 3.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 317.0389609 g/mol
Monoisotopic Mass 317.0389609 g/mol
Topological Polar Surface Area 69 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 412
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