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842955-68-4

842955-68-4 structural image
Product Name: 2-(5-METHYL-2H-[1,2,4]TRIAZOL-3-YLSULFANYL)-ETHYLAMINE
Formula: C5H10N4S
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COMPUTED DESCRIPTORS

Molecular Weight 158.23 g/mol
XLogP3 0.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 158.06261751 g/mol
Monoisotopic Mass 158.06261751 g/mol
Topological Polar Surface Area 92.9 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 99.6
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

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