4-(Benzyloxy)cyclohex-1-en-1-yl trifluoromethanesulfonate CAS 317831-30-4
| CAS No. | 317831-30-4 |
| Molecular Formula | C14H15F3O4S |
| Molecular Weight | 336.33 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
4-(Benzyloxy)cyclohex-1-en-1-yl trifluoromethanesulfonate (CAS 317831-30-4) is a high-purity analytical reference standard with the molecular formula C14H15F3O4S and a molecular weight of 336.33 g/mol.
Owing to a sulfone group, a carboxylic acid group, a hydroxyl group, an ether linkage, fluorine substitution, an aromatic ring system, 4-(Benzyloxy)cyclohex-1-en-1-yl trifluoromethanesulfonate is typically off-white to pale yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 336.33 g/mol — guide the selection of appropriate sample preparation and analytical techniques. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
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 | C14H15F3O4S |
| Molecular Weight | 336.33 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, 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; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 6.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F-containing |
| Sulfur Atoms | 1 |
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Recommended Standards
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- Dibenzothiophene-4-boronic Acid Pinacol Ester (CAS 912824-84-1)
- 2-(1,5,6,7-Tetrahydro-4H-indol-4-ylidene)acetonitrile (CAS 92573-23-4)
- 1-(3-(4-Fluorophenyl)-1H-pyrazol-4-yl)-N-methylmethanamine (CAS 1007521-55-2)
- 3-Chloro-5-(trifluoromethyl)pyridine (CAS 85148-26-1)
- 3-Bromo-2-chloro-5-methylthiophenol (CAS 1263377-14-5)
- Benzo[b]thiophene-4-carboximidamide hydrochloride (CAS 154650-84-7)
- tert-Butyl alaninate hydrochloride (CAS 69320-88-3)
- Biotinyl-Neuropeptide Y (human, rat) trifluoroacetate salt (CAS 213779-13-6)
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