866144-80-1
Product Name:
DIMETHYL 5-METHYL-1-(4-METHYLBENZYL)-1H-PYRROLE-2,4-DICARBOXYLATE
Formula:
C17H19NO4
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | 28.9 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
| Molecular Weight | 301.34 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 301.13140809 g/mol |
| Monoisotopic Mass | 301.13140809 g/mol |
| Topological Polar Surface Area | 57.5 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 404 |
| 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 |