Cjoc42

Chemical Information
| CAS Number | 2171519-89-2 |
| PubChem CID | 156017403 |
| IUPAC Name | methyl 4-[4-[3-(4-methylphenyl)sulfonyloxypropyl]triazol-1-yl]benzoate |
| Molecular Formula | C20H21N3O5S |
| Molecular Weight | 415.5 |
| XLogP | 3.2 |
| Topological Polar Surface Area | 109 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 9 |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 623 |
| Property | Value |
|---|---|
| Molecular Weight | 415.5 |
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 9 |
| Exact Mass | 415.12019195 |
| Monoisotopic Mass | 415.12019195 |
| Topological Polar Surface Area | 109 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 623 |
| 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 |
Alternative Products
| Catalog | Name |
|---|---|
| HY-138054-01 | Cjoc42 |
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