Description
2-Chloro-4-(4-chlorophenyl)-6-phenyl-1,3,5-triazine (CAS No. 30894-93-0) is a high-purity triazine derivative with the molecular formula C15H9Cl2N3. This compound features a symmetrical 1,3,5-triazine core substituted with two chlorine atoms and three aromatic rings, making it a versatile intermediate for organic synthesis and material science applications. With a molecular weight of 302.16 g/mol, it is supplied as a crystalline solid with >95% purity (HPLC) and is ideal for researchers developing agrochemicals, pharmaceuticals, or advanced polymers. The product is rigorously tested for identity (FTIR, NMR) and impurities (GC/MS) to ensure batch-to-batch consistency. Store in a cool, dry place under inert atmosphere to maintain stability.
Properties
- CAS Number: 30894-93-0
- Complexity: 301
- IUPAC Name: 2-chloro-4-(4-chlorophenyl)-6-phenyl-1,3,5-triazine
- InChI: InChI=1S/C15H9Cl2N3/c16-12-8-6-11(7-9-12)14-18-13(19-15(17)20-14)10-4-2-1-3-5-10/h1-9H
- InChI Key: HLRNODHPMNYHKS-UHFFFAOYSA-N
- Exact Mass: 301.0173527
- Molecular Formula: C15H9Cl2N3
- Molecular Weight: 302.2
- SMILES: C1=CC=C(C=C1)C2=NC(=NC(=N2)Cl)C3=CC=C(C=C3)Cl
- Topological: 38.7
- Monoisotopic Mass: 301.0173527
- Synonyms: 2-chloro-4-(4-chlorophenyl)-6-phenyl-1,3,5-triazine, 30894-93-0, DTXSID90275366, DTXCID90226813, 822-184-9, SCHEMBL20894683, ZB0177, SB66300, DB-192548, Chloro-4-(4-chlorophenyl)-6-phenyl-1,3,5-triazine
Application
This chlorinated triazine derivative serves as a key building block in the synthesis of herbicides and fungicides due to its electrophilic reactivity. It is utilized in cross-coupling reactions to create conjugated materials for organic electronics. Researchers also employ it as a precursor for photoactive compounds in optoelectronic devices. Its rigid aromatic structure makes it suitable for designing metal-organic frameworks (MOFs).
Safety and Hazards
GHS Hazard Statements
- H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
- H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
- H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
- H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statements
- P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Hazard Classes and Categories
- Acute Tox. 4 (100%)
- Skin Irrit. 2 (100%)
- Eye Irrit. 2 (100%)
- STOT SE 3 (100%)
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