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5533-38-0

5533-38-0 structural image
Product Name: 1-METHYL-1H-BENZIMIDAZOLE-2-SULFONIC ACID
Formula: C8H8N2O3S
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 31.5 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 212.23 g/mol
XLogP3 0.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 212.02556330 g/mol
Monoisotopic Mass 212.02556330 g/mol
Topological Polar Surface Area 80.6 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 311
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