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71005-12-4

71005-12-4 structural image
Product Name: 3-OXO-INDAN-4-CARBOXYLIC ACID
Formula: C10H8O3
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COMPUTED DESCRIPTORS

Molecular Weight 176.17 g/mol
XLogP3 1.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 176.047344113 g/mol
Monoisotopic Mass 176.047344113 g/mol
Topological Polar Surface Area 54.4 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 247
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