106840-79-3
Product Name:
Pyrrole-3-carboxylic acid, 2-methyl-5-nitro-, ethyl ester (6CI)
Formula:
C8H10N2O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 198.18 g/mol |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 198.06405680 g/mol |
| Monoisotopic Mass | 198.06405680 g/mol |
| Topological Polar Surface Area | 87.9 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 238 |
| 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 |