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937601-90-6

937601-90-6 structural image
Product Name: Methyl 3-nitro-4-(1H-pyrrol-1-yl)benzoate
Formula: C12H10N2O4
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COMPUTED DESCRIPTORS

Molecular Weight 246.22 g/mol
XLogP3 2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 246.06405680 g/mol
Monoisotopic Mass 246.06405680 g/mol
Topological Polar Surface Area 77 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 323
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