2-Fluoro-N-((6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)methyl)aniline CAS 877812-00-5
| CAS No. | 877812-00-5 |
| Molecular Formula | C14H17FN4 |
| Molecular Weight | 260.31 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
As a certified reference material (CRM), 2-Fluoro-N-((6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)methyl)aniline meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.
2-Fluoro-N-((6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)methyl)aniline (CAS 877812-00-5), molecular formula C14H17FN4 and molecular weight 260.31 g/mol, is a CATO reference standard with documented purity and traceability.
Based on its molecular formula C14H17FN4, 2-Fluoro-N-((6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)methyl)aniline contains a nitrogen-containing heterocyclic scaffold, a nitrile group, fluorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 260.31 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.
Physical & Chemical Properties
| Molecular Formula | C14H17FN4 |
| Molecular Weight | 260.31 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| 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.) | 1987 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 4 |
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Recommended Standards
- 2-Benzoyl-5-(1,3-dioxolan-2-yl)thiophene (CAS 898773-05-2)
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- 2-Amino-4-(3,4-dimethoxyphenyl)thiophene-3-carbonitrile (CAS 884497-31-8)
- 3-(1-Ethynylcyclohexyl)-1-(4-fluorophenyl)urea (CAS 866008-67-5)
- 3-Methyl-2,2-bis(phenylthio)-2,3-dihydrofuran (CAS 90141-36-9)
- 2-Hydroxy-7-methoxy-3,4-dihydronaphthalen-1(2H)-one (CAS 1528627-12-4)
- N-Benzyl-2,4-dichloroaniline (CAS 88450-68-4)
- 2-((1S,2S)-2-((tert-butoxycarbonyl)amino)cyclobutyl)acetic acid (CAS 1639216-47-9)
- 5-Bromo-2-mercaptoquinazolin-4(3H)-one (CAS 2231674-69-2)
- 2-(2-Fluoro-6-methoxyphenyl)acetic Acid (CAS 500912-19-6)
- 6-Chloro-2-(chloromethyl)-4-phenyl-quinazoline (CAS 34790-74-4)
- Salbutamol Impurity P (CAS CATO-C4X-1176161)
- (E)-7-styryl-[1,2,4]triazolo[1,5-a]pyrimidine (CAS 91823-31-3)
- Peptide 434 (CAS CATO-CPTD788434)
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