2059954-28-6
Product Name:
1H-1,2,4-Triazole-3-carboxylic acid, 1-(3-chlorophenyl)-5-(2-methylpropyl)-
Formula:
C13H14ClN3O2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 279.72 g/mol |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 279.0774544 g/mol |
| Monoisotopic Mass | 279.0774544 g/mol |
| Topological Polar Surface Area | 68 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 327 |
| 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 |