383147-46-4
Product Name:
1-[1-(1,3-BENZODIOXOL-5-YL)-1H-PYRROL-2-YL]-2,2,2-TRICHLORO-1-ETHANONE
Formula:
C13H8Cl3NO3
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COMPUTED DESCRIPTORS
Molecular Weight | 332.6 g/mol |
---|---|
XLogP3 | 4 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 2 |
Exact Mass | 330.956976 g/mol |
Monoisotopic Mass | 330.956976 g/mol |
Topological Polar Surface Area | 40.5 Ų |
Heavy Atom Count | 20 |
Formal Charge | 0 |
Complexity | 388 |
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 |