1217779-54-8 (2S)-2-{[(Benzyloxy)carbonyl]amino}-2-({[bis(benzyloxy)phosphoryl]oxy}methyl)-4-(4-octylphenyl)butyl acetate DTXSID30675684 CAS 1217779-54-8
| CAS No. | 1217779-54-8 |
| Molecular Formula | C43H54NO8P |
| Molecular Weight | 743.86 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of 1217779-54-8 (2S)-2-{[(Benzyloxy)carbonyl]amino}-2-({[bis(benzyloxy)phosphoryl]oxy}methyl)-4-(4-octylphenyl)butyl acetate DTXSID30675684 is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a phosphate ester group, a hydroxyl group, an ether linkage in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
1217779-54-8 (2S)-2-{[(Benzyloxy)carbonyl]amino}-2-({[bis(benzyloxy)phosphoryl]oxy}methyl)-4-(4-octylphenyl)butyl acetate DTXSID30675684 (CAS 1217779-54-8), molecular formula C43H54NO8P and molecular weight 743.86 g/mol, is a CATO reference standard with documented purity and traceability.
1217779-54-8 (2S)-2-{[(Benzyloxy)carbonyl]amino}-2-({[bis(benzyloxy)phosphoryl]oxy}methyl)-4-(4-octylphenyl)butyl acetate DTXSID30675684 (C43H54NO8P) contains a nitrogen-containing heterocyclic scaffold, an amide group, a phosphate ester group, a hydroxyl group, an ether linkage. The carboxyl group imparts weak acidity; these physicochemical properties determine the optimal preparation and storage of its standard solutions. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
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.
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 | C43H54NO8P |
| Molecular Weight | 743.86 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in methanol, acetonitrile, DMSO, water (slightly soluble) |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 17.5 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1990 |
| Nitrogen Atoms | 1 |
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Recommended Standards
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- Phenylmethyl 2-(Acetylamino)-2-deoxy-6-O-(phenylmethyl)-3-O-(2,3,4,6-tetra-O-acetyl-beta-D-galactopyranosyl)-alpha-D-glucopyranoside (CAS 71208-12-3)
- DBCO-PEG9-amine (CAS 2353409-99-9)
- Fast blue salt B (CAS 20282-70-6)
- 5-Chloropyrazole-3-carboxylic Acid (CAS 881668-70-8)
- 4-(5-Ethyl-1,2,4-oxadiazol-3-yl)-2-[(2-fluorophenyl)methyl]-1H,2H,3H,5H,6H,7H,8H-pyrido[1,2-c]pyrimidine-1,3-dione (CAS 1775345-51-1)
- Azilsartan Impurity 88 (CAS CATO-C4X-109688)
- 3-Chloro-2-(chloromethyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole (CAS 1251761-14-4)
- 2-(Benzylthio)-5-nitrothiazol-4-amine (CAS 845879-11-0)
- Ethyl 3-(1-Boc-4-hydroxy-4-piperidyl)propiolate (CAS 374794-90-8)
- Ethyl(5-bromopyrimidin-2-yl)glycinate (CAS 1159823-83-2)
- 7-(Butylthio)heptanoic acid (CAS 298684-64-7)
- Semaglutide Impurity 147 (CAS CATO-C4X-2226147)
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