33628-07-8
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 |