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7401-84-5

7401-84-5 structural image
Product Name: propan-2-yl 2-bromopropanoate
Formula: C6H11BrO2
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 947 945

COMPUTED DESCRIPTORS

Molecular Weight 195.05 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 193.99424 g/mol
Monoisotopic Mass 193.99424 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 101
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