83141-00-8
Product Name:
3-(2,5-dimethyl-1H-pyrrol-1-yl)-2-methylbenzoic acid
Formula:
C14H15NO2
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COMPUTED DESCRIPTORS
| Molecular Weight | 229.27 g/mol |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 229.110278721 g/mol |
| Monoisotopic Mass | 229.110278721 g/mol |
| Topological Polar Surface Area | 42.2 Ų |
| Heavy Atom Count | 17 |
| 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 |