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95420-72-7

95420-72-7 structural image
Product Name: 2-METHOXY-4-MERCAPTOBENZOIC ACID
Formula: C8H8O3S
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COMPUTED DESCRIPTORS

Molecular Weight 184.21 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 184.01941529 g/mol
Monoisotopic Mass 184.01941529 g/mol
Topological Polar Surface Area 47.5 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 172
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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