1-(3-Chlorophenyl)-4-oxocyclohexane-1-carbonitrile CAS 65619-29-6
| CAS No. | 65619-29-6 |
| Molecular Formula | C13H12ClNO |
| Molecular Weight | 233.69 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
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.
1-(3-Chlorophenyl)-4-oxocyclohexane-1-carbonitrile (CAS 65619-29-6) is a high-purity analytical reference standard with the molecular formula C13H12ClNO and a molecular weight of 233.69 g/mol.
Based on its molecular formula C13H12ClNO, 1-(3-Chlorophenyl)-4-oxocyclohexane-1-carbonitrile contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, chlorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 233.69 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. 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.
Physical & Chemical Properties
| Molecular Formula | C13H12ClNO |
| Molecular Weight | 233.69 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| 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) | 8.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1975 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 1 |
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Recommended Standards
- 1-(3-Chloro-phenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde (CAS 428467-92-9)
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- 1-(2-Chlorophenyl)-4-oxocyclohexane-1-carbonitrile (CAS 65618-88-4)
- 1-(4-Chlorophenyl)-4-oxocyclohexane-1-carbonitrile (CAS 25115-75-7)
- (-)-Isoledene（sum of enantiomers） (CAS 95910-36-4)
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- 1-(7-Methoxy-1-naphthalenyl)-2-propanone (CAS 118647-68-0)
- N-[2-(1H-Indol-3-yl)ethyl]-2,3,4,5,6-pentamethylbenzenesulfonamide (CAS 661475-56-5)
- Acetyl Tetrapeptide-11 (CAS 928006-88-6)
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