25016-17-5
Product Name:
5-METHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID METHYL ESTER
Formula:
C6H8N2O2
Synonyms:
5-Methyl-1H-pyrazole-3-carboxylic acid methyl ester;Methyl 5-methyl-1H-pyrazole-3-carboxylate
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COMPUTED DESCRIPTORS
| Molecular Weight | 140.14 g/mol |
|---|---|
| XLogP3 | 0.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 140.058577502 g/mol |
| Monoisotopic Mass | 140.058577502 g/mol |
| Topological Polar Surface Area | 55 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 138 |
| 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 |