N-[2-(allyloxy)benzyl]-N-1,3-benzodioxol-5-ylamine CAS 791600-96-9
| CAS No. | 791600-96-9 |
| Molecular Formula | C17H17NO3 |
| Molecular Weight | 283.32 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including N-[2-(allyloxy)benzyl]-N-1,3-benzodioxol-5-ylamine.
N-[2-(allyloxy)benzyl]-N-1,3-benzodioxol-5-ylamine (CAS 791600-96-9), molecular formula C17H17NO3 and molecular weight 283.32 g/mol, is a CATO reference standard with documented purity and traceability.
The molecular framework of N-[2-(allyloxy)benzyl]-N-1,3-benzodioxol-5-ylamine (C17H17NO3) is characterized by a steroid core, an amide group, a hydroxyl group, an ether linkage. 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.
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 | C17H17NO3 |
| Molecular Weight | 283.32 g/mol |
| Appearance | Pale yellow to yellow crystalline powder |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep sealed and dry |
| 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) | 10.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1986 |
| Nitrogen Atoms | 1 |
Related N Standards
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- 4-(Allyloxy)-5-methyl-1-phenyl-3-(trifluoromethyl)-1H-pyrazole (CAS 318949-57-4)
- 4-(Allyloxy)-2-bromo-5-ethoxybenzaldehyde (CAS 832674-05-2)
- 4-(Allyloxy)-3-bromo-5-ethoxybenzaldehyde (CAS 426232-67-9)
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Recommended Standards
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- N-benzoyl-l-phenylalanine methyl ester (CAS 3005-61-6)
- N-((1-(Hydroxymethyl)cyclopropyl)methyl)-1-naphthamide (CAS 1257552-10-5)
- Montelukast-d6 Sodium Salt (CAS 2673270-26-1)
- 3-(Carboxymethoxy)isoxazole-5-carboxylic acid (CAS 574005-34-8)
- (1r,3r)-3-(tert-butoxy)cyclobutan-1-amine hydrochloride (CAS 1955473-77-4)
- 6-(Benzyloxy)-3-methyl-1H-indole (CAS 92962-50-0)
- 4-(Chloromethyl)-1-ethyl-1H-pyrazole hydrochloride (CAS 1332529-52-8)
- Paliperidone Impurity 112 2HCl (CAS CATO-C4X-1724112)
- 2-(2-Chlorophenyl)-1,2-dihydro-5-phenyl-3H-1,2,4-triazol-3-one (CAS 246848-58-8)
- 2-Methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine hydrochloride (CAS 2138549-08-1)
- Neuropeptide S (rat) (CAS 412938-75-1)
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