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944709-39-1

944709-39-1 structural image
Product Name: 1-(2-chloroethyl)-1Hpyrrole-2,3-dicarboxylic acid
Formula: C8H8ClNO4
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COMPUTED DESCRIPTORS

Molecular Weight 217.60 g/mol
XLogP3 0.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 217.0141854 g/mol
Monoisotopic Mass 217.0141854 g/mol
Topological Polar Surface Area 79.5 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 246
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