4-(2-Trifluoromethylbenzoyl)isoquinoline CAS 1187171-58-9
| CAS No. | 1187171-58-9 |
| Molecular Formula | C17H10F3NO |
| Molecular Weight | 301.26 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-(2-Trifluoromethylbenzoyl)isoquinoline (CAS 1187171-58-9), molecular formula C17H10F3NO and molecular weight 301.26 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, 4-(2-Trifluoromethylbenzoyl)isoquinoline (C17H10F3NO) contains a steroid core, an amide group, a hydroxyl group, an ether linkage, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 12.0, corresponding to approximately 12 ring(s) or double-bond equivalent(s). With a molecular weight of 301.26 g/mol, it falls into the moderately-high-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
CATO manufactures 4-(2-Trifluoromethylbenzoyl)isoquinoline under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C17H10F3NO |
| Molecular Weight | 301.26 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (slight halide-like odor, low volatility) |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light |
| 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) | 12.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1989 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 1 |
Related Trifluoromethylbenzoyl Standards
- 4-(3-Trifluoromethylbenzoyl)isoquinoline (CAS 1187171-60-3)
- 4-(4-Trifluoromethylbenzoyl)isoquinoline (CAS 1187171-64-7)
- 4-(3-Trifluoromethylbenzoyl)quinoline (CAS 1706429-71-1)
- 4-(4-Trifluoromethylbenzoyl)quinoline (CAS 1706443-60-8)
- 4-(2-Trifluoromethylbenzoyl)quinoline (CAS 1706458-22-1)
- trans-4-(2-Trifluoromethylbenzoyl)-cyclohexane-1-carboxylic acid (CAS 1004529-52-5)
- 1-Acetyl-4-(3-Trifluoromethylbenzoyl)-piperidine (CAS 61714-98-5)
- 3-Methyl-2-(2-trifluoromethylbenzoyl)pyridine (CAS 1187165-72-5)
Recommended Standards
- Quinolin-3-yl(4-(trifluoromethyl)phenyl)methanone (CAS 1187167-58-3)
- Quinolin-3-yl(3-(trifluoromethyl)phenyl)methanone (CAS 1187166-83-1)
- Quinolin-3-yl(2-(trifluoromethyl)phenyl)methanone (CAS 1187165-86-1)
- 3-(Benzyloxy)-1-(2,2,2-trifluoroacetyl)piperidin-4-one (CAS 1189113-59-4)
- 4-Acetyl-2,5-dimethylfuran-3(2H)-one (CAS 36871-78-0)
- N-(1-cyanoethyl)-2-(2,6-dioxo-3-piperidyl)-1-oxo-isoindoline-5-carboxamide (CAS 2629201-62-1)
- 3-Ethynyl-2,6-dimethylpyridine (CAS 1824462-73-8)
- 3-Bromo-5-phenylpyrazin-2(1H)-one (CAS 67602-02-2)
- 3-(4-Ethoxyphenyl)-N-(4-ethylphenyl)acrylamide (CAS 431066-99-8)
- ((2,2,2-Trifluoroethoxy)carbonyl)proline (CAS 1309020-00-5)
- 4-(Bromomethyl)pyridin-3-amine (CAS 1227601-35-5)
- Varenicline Impurity 39 Sodium Salt (CAS 608-89-9(free base))
- 2-(3,5-Dichloropyridin-2-yl)-5-methyl-2H-1,2,3-triazole-4-carboxylic acid (CAS 1431728-04-9)
- Valosin Peptide (VQY), porcine (CAS 99510-37-9)
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