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117-27-1

117-27-1 structural image
Product Name: CS 645A
Formula: C15H13Cl2NO2
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 2250 2259.1 2250

COMPUTED DESCRIPTORS

Molecular Weight 310.2 g/mol
XLogP3 5.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 309.0323340 g/mol
Monoisotopic Mass 309.0323340 g/mol
Topological Polar Surface Area 45.8 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 296
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes