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885273-55-2

885273-55-2 structural image
Product Name: METHYL 3-(2-CARBOXY-VINYL)-5-METHANESULFONYL-1H-INDOLE-2-CARBOXYLATE
Formula: C14H13NO6S
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COMPUTED DESCRIPTORS

Molecular Weight 323.32 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 323.04635831 g/mol
Monoisotopic Mass 323.04635831 g/mol
Topological Polar Surface Area 122 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 579
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes