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869943-05-5

869943-05-5 structural image
Product Name: 2-[(3-METHYL-THIOPHEN-2-YLMETHYL)-AMINO]-BUTAN-1-OL
Formula: C10H17NOS
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 26.6 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 199.32 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 199.10308534 g/mol
Monoisotopic Mass 199.10308534 g/mol
Topological Polar Surface Area 60.5 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 143
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes