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874279-27-3

874279-27-3 structural image
Product Name: 2-Methanesulfonyl-pyrimidine-4-carbaldehyde
Formula: C6H6N2O3S
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COMPUTED DESCRIPTORS

Molecular Weight 186.19 g/mol
XLogP3 -0.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 186.00991323 g/mol
Monoisotopic Mass 186.00991323 g/mol
Topological Polar Surface Area 85.4 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 257
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