4-(Trifluoromethyl)benzyl carbamimidothioate hydrochloride CAS 477708-87-5
| CAS No. | 477708-87-5 |
| Molecular Formula | C9H9F3N2S |
| Molecular Weight | N/A |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The molecular framework of 4-(Trifluoromethyl)benzyl carbamimidothioate hydrochloride (C9H9F3N2SHCl) is characterized by a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine/chlorine substitution. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).
CATO supplies 4-(Trifluoromethyl)benzyl carbamimidothioate hydrochloride (CAS 477708-87-5), a certified reference material (molecular formula C9H9F3N2SHCl, MW 270.70 g/mol) for analytical method development and quality control.
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 | C9H9F3N2S HCl |
| Molecular Weight | 270.70 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) | 4.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F/Cl-containing |
| Nitrogen Atoms | 2 |
| Sulfur Atoms | 1 |
Related Trifluoromethyl Standards
- 3-(4-(Trifluoromethyl)phenyl)pyrrolidin-3-ol hydrochloride (CAS 1000198-74-2)
- 3-(4-(Trifluoromethyl)phenyl)pyrrolidine (CAS 1000198-76-4)
- (2-Methyl-4-(trifluoromethyl)thiazol-5-yl)methanol (CAS 1000339-72-9)
- methyl 3-((4-(trifluoromethyl)piperidin-1-yl)methyl)benzoate (CAS 1000339-86-5)
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- 2-(4-(trifluoromethyl)piperidin-1-yl)thiazole-5-carbaldehyde (CAS 1000339-88-7)
- 3-(2-(4-(trifluoromethyl)piperidin-1-yl)ethyl)benzaldehyde (CAS 1000339-89-8)
- 4-(2-(4-(trifluoromethyl)piperidin-1-yl)acetyl)-1H-pyrrole-2-carbaldehyde (CAS 1000339-90-1)
Recommended Standards
- methyl 5-bromo-4-fluoro-1H-pyrrole-3-carboxylate (CAS 2092695-82-2)
- 2-(5-Amino-3-(pyrazin-2-yl)-1H-pyrazol-1-yl)ethan-1-ol (CAS 1708037-48-2)
- 6-Hydroxy-2,6-dimethylhept-2-en-4-one (Semiphorone) (CAS 5857-71-6)
- (R)-2-fluoro-4-(pyrrolidin-2-yl)aniline (CAS 1213445-56-7)
- Ipragliflozin Impurity 3 (CAS CATO-C4X-18853)
- 4-METHYL-3-(HYDROXYMETHYL)MORPHOLINE HCL (CAS 1956379-95-5)
- (1-Methyl-1H-pyrazol-4-yl)boronic acid hydrochloride (CAS 1026796-02-0)
- 4-Fluoro-n-methyl-n'-(3-methyl-1-phenyl-1h-pyrazol-5-yl)benzene-1-carboximidamide (CAS 380394-41-2)
- 1-(4-Chlorophenyl)-3-[(4-methoxyphenyl)sulfanyl]propan-1-one (CAS 320422-67-1)
- Semaglutide impurity 194 (CAS CATO-C4X-2226194)
Why CATO?
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