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17874-32-7

17874-32-7 structural image
Product Name: 6-TERT-BUTYL-4-METHYLCOUMARIN
Formula: C14H16O2
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COMPUTED DESCRIPTORS

Molecular Weight 216.27 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 216.115029749 g/mol
Monoisotopic Mass 216.115029749 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 322
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