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587828-18-0

587828-18-0 structural image
Product Name: 2-TERT-BUTYL-3-FORMYL-1H-INDOLE-5-CARBONITRILE
Formula: C14H14N2O
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COMPUTED DESCRIPTORS

Molecular Weight 226.27 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 226.110613074 g/mol
Monoisotopic Mass 226.110613074 g/mol
Topological Polar Surface Area 56.6 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 349
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