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950-86-7

950-86-7 structural image
Product Name: 5-(2-CHLORO-ACETYL)-2,4-DIMETHYL-1H-PYRROLE-3-CARBOXYLIC ACID ETHYL ESTER
Formula: C11H14ClNO3
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COMPUTED DESCRIPTORS

Molecular Weight 243.68 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 243.0662210 g/mol
Monoisotopic Mass 243.0662210 g/mol
Topological Polar Surface Area 59.2 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 282
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