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76937-78-5

76937-78-5 structural image
Product Name: INDOLE-2,4,5,6,7-D5-3-ACETIC ACID
Formula: C10H4D5NO2
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COMPUTED DESCRIPTORS

Molecular Weight 180.21 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 180.094712260 g/mol
Monoisotopic Mass 180.094712260 g/mol
Topological Polar Surface Area 53.1 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 205
Isotope Atom Count 5
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