3-(3-fluorophenyl)-1,4-dimethyl-4,5-dihydro-1H-1,2,4-triazole-5-thione CAS 110623-33-1
| CAS No. | 110623-33-1 |
| Molecular Formula | C10H10FN3S |
| Molecular Weight | 223.27 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The molecular framework of 3-(3-fluorophenyl)-1,4-dimethyl-4,5-dihydro-1H-1,2,4-triazole-5-thione (C10H10FN3S) is characterized by a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine substitution. In reversed-phase chromatography, its retention is governed primarily by its high hydrophobicity (logP), which provides a practical basis for HPLC-UV/DAD or LC-MS method development. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
3-(3-fluorophenyl)-1,4-dimethyl-4,5-dihydro-1H-1,2,4-triazole-5-thione (CAS 110623-33-1) is a high-purity analytical reference standard with the molecular formula C10H10FN3S and a molecular weight of 223.27 g/mol.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
CATO manufactures 3-(3-fluorophenyl)-1,4-dimethyl-4,5-dihydro-1H-1,2,4-triazole-5-thione 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 | C10H10FN3S |
| Molecular Weight | 223.27 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) | 7.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1988 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 3 |
| Sulfur Atoms | 1 |
Related fluorophenyl Standards
- 3-(2-Fluorophenyl)-4-methyl-5-(methylthio)-4H-1,2,4-triazole (CAS 116850-50-1)
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- 4-Ethyl-5-(2-fluorophenyl)-4H-[1,2,4]triazole-3-thiol (CAS 138417-36-4)
- 3-(3-Fluorophenyl)-4-methyl-5-(methylthio)-4H-1,2,4-triazole (CAS 144165-20-8)
- 1-[5-(2-fluorophenyl)-1,3,4-thiadiazol-2-yl]ethan-1-amine (CAS 1542100-93-5)
- 4-Ethyl-5-(3-fluorophenyl)-4H-[1,2,4]triazole-3-thiol (CAS 168968-56-7)
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