52459-90-2
Product Name:
1H-Pyrrole-3-carboxylicacid,2,4-dimethyl-,methylester(9CI)
Formula:
C8H11NO2
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COMPUTED DESCRIPTORS
| Molecular Weight | 153.18 g/mol |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 153.078978594 g/mol |
| Monoisotopic Mass | 153.078978594 g/mol |
| Topological Polar Surface Area | 42.1 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 158 |
| 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 |