2-(4-Isocyanatophenyl)acetonitrile CAS 59513-89-2
| CAS No. | 59513-89-2 |
| Molecular Formula | C9H6N2O |
| Molecular Weight | 158.16 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Based on its molecular formula C9H6N2O, 2-(4-Isocyanatophenyl)acetonitrile contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 158.16 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
CATO supplies 2-(4-Isocyanatophenyl)acetonitrile (CAS 59513-89-2), a certified reference material (molecular formula C9H6N2O, MW 158.16 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.
CATO manufactures 2-(4-Isocyanatophenyl)acetonitrile under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C9H6N2O |
| Molecular Weight | 158.16 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (faint amine-like odor) |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 8.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1974 |
| Nitrogen Atoms | 2 |
Related Isocyanatophenyl Standards
- (4-isocyanatophenyl)(methyl)sulfane 1632-84-4 4-(Methylsulfanyl)phenyl isocyanate (CAS 1632-84-4)
- 1-(3-Isocyanatophenyl)-N,N-dimethylmethanamine (CAS 1001185-00-7)
- 1-(4-ISocyanatophenyl)-1h-pyrrole (CAS 857283-60-4)
- 2-(4-Isocyanatophenyl)furan (CAS 859850-66-1)
- Methyl 2-(2-isocyanatophenyl)acetate (CAS 347877-90-1)
- 2-(4-Isocyanatophenyl)pyrimidine (CAS 216059-84-6)
- 3-(4-Isocyanatophenyl)-1-methyl-1H-pyrazole (CAS 921938-54-7)
- 5-(3-Isocyanatophenyl)-1-methyl-1H-pyrazole (CAS 941716-86-5)
Recommended Standards
- 2-(3-Oxopiperazin-2-yl)acetic acid (CAS 405214-33-7)
- 2-(Azidomethyl)benzonitrile (CAS 40508-03-0)
- 2-(3-oxo-2,3-dihydropyridazin-4-yl)acetic acid (CAS 62089-16-1)
- 2-(Benzo[d]isoxazol-3-yl)acetonitrile (CAS 50471-17-5)
- Methyl 4-iodo-1-tosyl-1H-pyrrole-2-carboxylate (CAS 869886-85-1)
- 7-Butyl-4-hydroxy-3,8,9-trimethoxybenzo[g]quinoline-5,10-dione (CAS 61186-58-1)
- 2-azabicyclo[3.1.1]heptane-1-carboxylic acid hydrochloride (CAS 1172802-41-3)
- 3-Styrylquinoxalin-2(1H)-one (CAS 6323-89-3)
- Calyciphylline A (CAS 596799-30-3)
- N-hydroxy-2-(4-oxo-2-(thiophen-2-yl)pyrazolo[1,5-a]pyrazin-5(4H)-yl)acetimidamide (CAS 1255791-12-8)
- 1,3-dioxane-2-carboxylic acid (CAS 204527-26-4)
- 2-Chloro-5-isopropoxypyridine (CAS 1204483-99-7)
- 6-(1-Methylethyl)-1-(phenylmethyl)-1H-indole-2-carboxylic Acid (CAS 1240579-16-1)
- Semaglutide impurity 31 (CAS CATO-C4X-222631)
Why CATO?
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