Pentacosane, 13-phenyl-
pentacosan-13-ylbenzene
Also Known As: Pentacosane, 13-phenyl-|13-Phenylpentacosane|pentacosan-13-ylbenzene|Pentacosane,13-phenyl|Benzene, (1-dodecyltridecyl)-|(pentacosan-13-yl)benzene|(1-Dodecyltridecyl)benzene #|C(CCCCCCCCCCCC)(CCCCCCCCCCCC)c1ccccc1
CAS: 6006-90-2
| Molecular Formula | C31H56 |
|---|---|
| Molecular Weight | 428.4382 g/mol |
| LogP | 15.0 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 23 |
| Exact Mass | 428.4382 |
| Monoisotopic Mass | 428.4382 |
| Heavy Atoms | 31 |
| Complexity | 303.0 |
Chemical Identifiers
| CAS Number | 6006-90-2 |
|---|---|
| SMILES | CCCCCCCCCCCCC(CCCCCCCCCCCC)C1=CC=CC=C1 |
| InChIKey | FARZSOUCOJBKMW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (6 patents)
Product Overview
Pentacosane, 13-phenyl- (CAS 6006-90-2), with molecular formula C31H56 and molecular weight 428.4382 g/mol. IUPAC: pentacosan-13-ylbenzene.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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