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602-29-9

602-29-9 structural image
Product Name: 2,3,4-TRINITROTOLUENE
Formula: C7H5N3O6
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COMPUTED DESCRIPTORS

Molecular Weight 227.13 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 0
Exact Mass 227.01783489 g/mol
Monoisotopic Mass 227.01783489 g/mol
Topological Polar Surface Area 138 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 316
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