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33628-07-8

33628-07-8 structural image
Product Name: 2-(3-(5-CHLORO-1-SULFO PROPYL-3-ETHYL-6-TRIFLUOROMETHYL-2-BENZIMIDAZOLINYLIDENE) PROPENYL)-5-CHLORO-3-ETHYL-1-SULFOPROPYL-6-TRIFLUOROMETHYL BENZIMIDAZOLIUM HYDROXIDE, INNER SALT, SODIUM SALT
Formula: C29H29Cl2F6N4NaO6S2
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COMPUTED DESCRIPTORS

Molecular Weight 829.6 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 14
Rotatable Bond Count 12
Exact Mass 828.1020458 g/mol
Monoisotopic Mass 828.1020458 g/mol
Topological Polar Surface Area 146 Ų
Heavy Atom Count 52
Formal Charge 0
Complexity 1330
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 2
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes