Description
2-(4-Chlorophenyl)benzoxazole (CAS No. 1141-35-1) is a high-purity organic compound with the molecular formula C13H8ClNO. This heterocyclic aromatic compound features a benzoxazole core substituted with a 4-chlorophenyl group at the 2-position, making it a valuable intermediate in synthetic chemistry and material science applications. Its crystalline structure and well-defined properties ensure consistency for research and industrial use. Ideal for pharmaceutical development, agrochemical synthesis, and optoelectronic material research, this compound is rigorously tested for purity and stability. Available in various quantities with detailed analytical data (HPLC, NMR, MS) to meet stringent laboratory requirements.
Properties
- CAS Number: 1141-35-1
- Complexity: 240
- IUPAC Name: 2-(4-chlorophenyl)-1,3-benzoxazole
- InChI: InChI=1S/C13H8ClNO/c14-10-7-5-9(6-8-10)13-15-11-3-1-2-4-12(11)16-13/h1-8H
- InChI Key: NTMAGNRMERGORC-UHFFFAOYSA-N
- Exact Mass: 229.0294416
- Molecular Formula: C13H8ClNO
- Molecular Weight: 229.66
- SMILES: C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)Cl
- Topological: 26
- Monoisotopic Mass: 229.0294416
- Synonyms: 1141-35-1, 2-(4-Chlorophenyl)benzoxazole, BENZOXAZOLE, 2-(p-CHLOROPHENYL)-, CWX8HK6VVA, DTXSID80150653, DTXCID2073144, 2-(4-chlorophenyl)-1,3-benzoxazole, 2-(4-Chloro-phenyl)-benzooxazole, 2-(4-chlorophenyl)benzo[d]oxazole, Benzoxazole, 2-(4-chlorophenyl)-, 2-(p-Chlorophenyl)benzoxazole, CCRIS 7881, MFCD00453917, UNII-CWX8HK6VVA, SCHEMBL141648, SCHEMBL693715, SCHEMBL694958, 2-(p-chloro-phenyl)benzoxazole, SCHEMBL2245548, SCHEMBL9112520, 2-(4-chlorophenyl)-benzooxazole, NTMAGNRMERGORC-UHFFFAOYSA-N, STK156354, AKOS000649531, NCGC00338707-01, AC-20985, AS-60996, CS-0060597, ST50340244, W18769, AB01330865-02, 5128-54-1
Application
2-(4-Chlorophenyl)benzoxazole serves as a key building block in the synthesis of pharmaceuticals, particularly in the development of antimicrobial and anti-inflammatory agents. Its benzoxazole scaffold is utilized in agrochemical research for designing novel pesticides and herbicides. Additionally, this compound is investigated for its potential in organic light-emitting diodes (OLEDs) due to its fluorescence properties. Researchers also explore its use in coordination chemistry as a ligand for metal complexes.
Safety and Hazards
GHS Hazard Statements
- H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
- H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statements
- P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364
Hazard Classes and Categories
- Skin Irrit. 2 (100%)
- Eye Irrit. 2 (100%)
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