61516-81-2
Product Name:
2-(2,5-DIOXOTETRAHYDRO-1H-PYRROL-1-YL)ACETONITRILE
Formula:
C6H6N2O2
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COMPUTED DESCRIPTORS
Molecular Weight | 138.12 g/mol |
---|---|
XLogP3 | -1.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 1 |
Exact Mass | 138.042927438 g/mol |
Monoisotopic Mass | 138.042927438 g/mol |
Topological Polar Surface Area | 61.2 Ų |
Heavy Atom Count | 10 |
Formal Charge | 0 |
Complexity | 209 |
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 |