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13281-03-3

13281-03-3 structural image
Product Name: 1-OCTYL-2-THIOUREA
Formula: C9H20N2S
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COMPUTED DESCRIPTORS

Molecular Weight 188.34 g/mol
XLogP3 3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 7
Exact Mass 188.13471982 g/mol
Monoisotopic Mass 188.13471982 g/mol
Topological Polar Surface Area 70.1 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 115
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