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148854-09-5

148854-09-5 structural image
Product Name: Benzene, 1-bromo-3-isocyano- (9CI)
Formula: C7H4BrN
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COMPUTED DESCRIPTORS

Molecular Weight 182.02 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 180.95271 g/mol
Monoisotopic Mass 180.95271 g/mol
Topological Polar Surface Area 4.4 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 135
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