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339099-42-2

339099-42-2 structural image
Product Name: 2-((2-[2,4-DICHLORO-5-(2-PROPYNYLOXY)ANILINO]-2-OXOETHYL)SULFANYL)ACETIC ACID
Formula: C13H11Cl2NO4S
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COMPUTED DESCRIPTORS

Molecular Weight 348.2 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 7
Exact Mass 346.9785844 g/mol
Monoisotopic Mass 346.9785844 g/mol
Topological Polar Surface Area 101 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 426
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