684236-66-6
Product Name:
1H-Pyrazole-3-carboxylic acid, 5-acetyl-, methyl ester (9CI)
Formula:
C7H8N2O3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 168.15 g/mol |
|---|---|
| XLogP3 | 0.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 168.05349212 g/mol |
| Monoisotopic Mass | 168.05349212 g/mol |
| Topological Polar Surface Area | 72 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 205 |
| 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 |