4-(Heptyloxy)phenyl 4-(trans-4-pentylcyclohexyl)benzoate CAS 84601-02-5
| CAS No. | 84601-02-5 |
| Molecular Formula | C31H44O3 |
| Molecular Weight | 464.68 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
4-(Heptyloxy)phenyl 4-(trans-4-pentylcyclohexyl)benzoate (CAS 84601-02-5), molecular formula C31H44O3 and molecular weight 464.68 g/mol, is a CATO reference standard with documented purity and traceability.
Based on its molecular formula C31H44O3, 4-(Heptyloxy)phenyl 4-(trans-4-pentylcyclohexyl)benzoate contains a carboxylic acid group, a hydroxyl group, an ether linkage, a polycyclic aromatic system; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 464.68 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).
The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.
Physical & Chemical Properties
| Molecular Formula | C31H44O3 |
| Molecular Weight | 464.68 g/mol |
| Appearance | Pale yellow to yellow crystalline powder |
| Purity | 97%+ |
| Storage | Store at room temperature, protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in chloroform, dichloromethane, ethyl acetate, DMSO |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 10.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1981 |
Related Heptyloxy Standards
- 3-(Heptyloxy)-N-[2-(2-phenoxyethoxy)benzyl]aniline (CAS 1040680-33-8)
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- 3-(Heptyloxy)-N-[2-(2-isopropylphenoxy)ethyl]-aniline (CAS 1040679-91-1)
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