717871-76-6
Product Name:
Benzoyl chloride, 4-(4H-1,2,4-triazol-4-yl)- (9CI)
Formula:
C9H6ClN3O
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COMPUTED DESCRIPTORS
| Molecular Weight | 207.61 g/mol |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 207.0199395 g/mol |
| Monoisotopic Mass | 207.0199395 g/mol |
| Topological Polar Surface Area | 47.8 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 210 |
| 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 |