3-(Benzo[d][1,3]dioxol-5-yl)isoxazole-4-carbonitrile CAS 55836-73-2
| CAS No. | 55836-73-2 |
| Molecular Formula | - |
| Molecular Weight | 263.10 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
3-(Benzo[d][1,3]dioxol-5-yl)isoxazole-4-carbonitrile (CAS 55836-73-2) is a high-purity analytical reference standard with the molecular formula C7H13D2Cl2N2O2P and a molecular weight of 263.10 g/mol.
The molecular framework of 3-(Benzo[d][1,3]dioxol-5-yl)isoxazole-4-carbonitrile (C7H13D2Cl2N2O2P) is characterized by deuterium isotope labeling, an amide group, organophosphorus functionality, a carboxylic acid group, a hydroxyl group, an ether linkage, 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. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
As a certified reference material (CRM), 3-(Benzo[d][1,3]dioxol-5-yl)isoxazole-4-carbonitrile 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 | C7H13D2Cl2N2O2P |
| Molecular Weight | 263.10 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep sealed and dry, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 1.5 |
| CAS Registry Year (est.) | 1972 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 2 |
Related Benzo Standards
- 1-((Benzo[d][1,3]dioxol-5-yloxy)methyl)-4-nitro-1h-pyrazole (CAS 1172507-48-0)
- 3-(Benzo[d]oxazol-2-ylthio)-1,1,1-trifluoropropan-2-ol (CAS 1406266-57-6)
- 2-(1H-Benzo[d]imidazol-2-yl)isoindoline-1,3-dione (CAS 27111-40-6)
- 2-(Benzo[d][1,3]dioxol-5-yl)-1-methyl-5-oxopyrrolidine-3-carboxylic acid (CAS 75810-48-9)
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- Methyl 2-(benzo[d][1,3]dioxol-5-yl)thiazole-5-carboxylate (CAS 1311882-51-5)
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Recommended Standards
- 3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl acetate (CAS 2096334-94-8)
- 3-Hydroxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide (CAS 2922675-17-8)
- 2-Methyl-5-nitrophenylboronic Acid Pinacol Ester (CAS 957062-84-9)
- 3-Methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)picolinaldehyde (CAS 2096331-70-1)
- 1-(Dimethylamino)-4-phenoxypent-1-en-3-one (CAS 338976-01-5)
- 7-Chloro-8-(diethylamino)quinoline-5,6-dione (CAS 25943-57-1)
- 4-Fluoro-3,3-dimethyl-2,3-dihydro-1H-inden-1-one (CAS 1501959-50-7)
- Olopatadine Impurity 66 (CAS CATO-C4X-171866)
- [1-(3-phenylpropyl)-1h-imidazol-2-yl]methanamine (CAS 1250704-89-2)
- VER-50589 (CAS 747413-08-7)
- 2-({[(3-bromophenyl)methyl]carbamoyl}amino)-2-methylpropanoic acid (CAS 953726-14-2)
- 1-[(4S)-4-(1-Methylethyl)-2-thioxo-3-oxazolidinyl]-1-propanone (CAS 113023-57-7)
- (S)-1-(tert-Butoxycarbonyl)-2-(naphthalen-2-ylmethyl)pyrrolidine-2-carboxylic acid (CAS 1217648-30-0)
- Semaglutide impurity 22(OtBu-Ste-γGlu(OtBu)-AEEA-AEEA-OH) (CAS 1118767-16-0)
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