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515828-87-2

515828-87-2 structural image
Product Name: 2-bromo-5-methoxy-4-propoxybenzonitrile
Formula: C11H12BrNO2
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COMPUTED DESCRIPTORS

Molecular Weight 270.12 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 269.00514 g/mol
Monoisotopic Mass 269.00514 g/mol
Topological Polar Surface Area 42.2 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 238
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

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