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2595-46-2

2595-46-2 structural image
Product Name: Ethyl 1-thio-beta-D-xylopyranoside
Formula: C7H14O4S
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COMPUTED DESCRIPTORS

Molecular Weight 194.25 g/mol
XLogP3 -0.8
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 194.06128010 g/mol
Monoisotopic Mass 194.06128010 g/mol
Topological Polar Surface Area 95.2 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 143
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes