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37906-84-6

37906-84-6 structural image
Product Name: 1,2-Propanediol, 3-bromo-, 1-acetate
Formula: C5H9BrO3
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COMPUTED DESCRIPTORS

Molecular Weight 197.03 g/mol
XLogP3 0.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 195.97351 g/mol
Monoisotopic Mass 195.97351 g/mol
Topological Polar Surface Area 46.5 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 94.2
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