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17454-42-1

17454-42-1 structural image
Product Name: CYCLOHEXANO-12-CROWN-4, MIXTURE OF CIS AND TRANS, 93
Formula: C12H22O4
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COMPUTED DESCRIPTORS

Molecular Weight 230.30 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 230.15180918 g/mol
Monoisotopic Mass 230.15180918 g/mol
Topological Polar Surface Area 36.9 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 166
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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