N-(benzo[d][1,3]dioxol-5-ylmethyl)-2-(4-fluorophenyl)ethan-1-amine hydrochloride CAS 435345-36-1
| CAS No. | 435345-36-1 |
| Molecular Formula | C16H16FNO2 |
| Molecular Weight | N/A |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
CATO supplies N-(benzo[d][1,3]dioxol-5-ylmethyl)-2-(4-fluorophenyl)ethan-1-amine hydrochloride (CAS 435345-36-1), a certified reference material (molecular formula C16H16FNO2HCl, MW 309.76 g/mol) for analytical method development and quality control.
Structurally, N-(benzo[d][1,3]dioxol-5-ylmethyl)-2-(4-fluorophenyl)ethan-1-amine hydrochloride (C16H16FNO2HCl) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 8.0, corresponding to approximately 8 ring(s) or double-bond equivalent(s). With a molecular weight of 309.76 g/mol, it falls into the moderately-high-molecular-weight range. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.
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.
As a certified reference material (CRM), N-(benzo[d][1,3]dioxol-5-ylmethyl)-2-(4-fluorophenyl)ethan-1-amine hydrochloride 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.
Physical & Chemical Properties
| Molecular Formula | C16H16FNO2 HCl |
| Molecular Weight | 309.76 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; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 8.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F/Cl-containing |
| Nitrogen Atoms | 1 |
Related N Standards
- 4-(Benzo[d]thiazol-2-yl)butanamide (CAS 100060-13-7)
- 1-(Benzo[d]thiazol-2-yl)-N-methylcyclohexan-1-amine (CAS 1000931-32-7)
- Methyl 4-(benzo[d]thiazol-2-yl)butanoate (CAS 100192-34-5)
- 7-Methyl-benzo[1,2-d;4,3-d]bisthiazol-2-ylamine (CAS 10023-29-7)
- 6-(Benzo[d]thiazol-2-yl)picolinic acid (CAS 100283-51-0)
- 3-(Benzo[b]thiophen-3-yl)-2-methylpropanoic acid (CAS 100518-73-8)
- Benzo[d]thiazole-6-carbohydrazide (CAS 1005205-15-1)
- 2-(Benzo[d]thiazol-2-yl)benzo[d]isothiazol-3(2H)-one (CAS 100527-13-7)
Recommended Standards
- tert-Butyl (5-iodopyrazin-2-yl)carbamate (CAS 1816293-92-1)
- 3-Bromo-6-isopropoxypicoline (CAS 1239611-34-7)
- tert-Butyl (1-(2-hydroxyethyl)azetidin-3-yl)(methyl)carbamate (CAS 1956380-79-2)
- N-Methyl-2-(4-sulfamoylphenoxy)acetamide (CAS 1549443-43-7)
- Decahydroquinoline-6-carboxamide (CAS 1052559-55-3)
- Methyl 6-(hydroxy(phenyl)methyl)nicotinate (CAS 63362-42-5)
- Metazachlor Impurity 3 (CAS 2345-61-1)
- [(2E)-2-methyl-3-phenylprop-2-en-1-yl](prop-2-en-1-yl)amine hydrochloride (CAS 1240590-74-2)
- Etiracetam Carboxylic Acid Ethyl Ester (CAS 86815-10-3)
- Eosinophilotactic Peptide (CAS 61756-28-3)
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