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90484-76-7

90484-76-7 structural image
Product Name: 1-Butanol, 3-amino-4-mercapto-
Formula: C4H11NOS
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COMPUTED DESCRIPTORS

Molecular Weight 121.20 g/mol
XLogP3 -0.7
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 121.05613515 g/mol
Monoisotopic Mass 121.05613515 g/mol
Topological Polar Surface Area 47.2 Ų
Heavy Atom Count 7
Formal Charge 0
Complexity 42.7
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