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Homecas115546-28-6

115546-28-6

115546-28-6 structural image
Product Name: ROSE BENGAL, METHYL ESTER
Formula: C22H8Cl4I4O5
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COMPUTED DESCRIPTORS

Molecular Weight 1001.7 g/mol
XLogP3 9.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 1001.5275 g/mol
Monoisotopic Mass 999.5305 g/mol
Topological Polar Surface Area 54 Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 810
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 1
Compound Is Canonicalized Yes