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68750-23-2

68750-23-2 structural image
Product Name: 1,5-Pentanediol, monoacetate
Formula: C7H14O3
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COMPUTED DESCRIPTORS

Molecular Weight 164.20 g/mol
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 164.10485899 g/mol
Monoisotopic Mass 164.10485899 g/mol
Topological Polar Surface Area 77.8 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 56.3
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 2
Compound Is Canonicalized Yes