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161156-01-0

161156-01-0 structural image
Product Name: 4,6,7-TRIMETHOXY-1H-INDOLE-2-CARBOXYLIC ACID
Formula: C12H13NO5
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COMPUTED DESCRIPTORS

Molecular Weight 251.23 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 251.07937252 g/mol
Monoisotopic Mass 251.07937252 g/mol
Topological Polar Surface Area 80.8 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 311
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