112677-06-2
Product Name:
(E)-3-(DIMETHYLAMINO)-1-(1H-PYRROL-2-YL)PROP-2-EN-1-ONE
Formula:
C9H12N2O
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COMPUTED DESCRIPTORS
| Molecular Weight | 164.20 g/mol |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 164.094963011 g/mol |
| Monoisotopic Mass | 164.094963011 g/mol |
| Topological Polar Surface Area | 36.1 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 187 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |