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2-chloro-4,6-diphenyl-1,3,5-triazine

Catalog Number
ACM3842555
CAS Number
3842-55-5
Product Name
2-chloro-4,6-diphenyl-1,3,5-triazine
Category
Small Molecule Semiconductor Building Blocks; Electroluminescence Materials; Organic Light-Emitting Diode (OLED) Materials; Other Electronic Materials
Synonyms
CITPTA
IUPAC Name
2-chloro-4,6-diphenyl-1,3,5-triazine
Molecular Weight
267.71
Molecular Formula
C15H10ClN3
Canonical SMILES
C1=CC=C(C=C1)C2=NC(=NC(=N2)Cl)C3=CC=CC=C3
InChI
InChI=1S/C15H10ClN3/c16-15-18-13(11-7-3-1-4-8-11)17-14(19-15)12-9-5-2-6-10-12/h1-10H
InChI Key
DDGPPAMADXTGTN-UHFFFAOYSA-N
Boiling Point
138 - 140 °C
Melting Point
485.1 ± 28.0 °C
Purity
95%+
Density
1.265 ± 0.06 g/ml
Appearance
White to Yellow to Orange powder to crystal
Application
2-Chloro-4,6-diphenyl-1,3,5-triazine, typically appearing as a yellow powder, serves a crucial role as an organic compound intermediary in the development of various advanced materials. This compound is instrumental in synthesizing benzimidazole compounds and their derivatives, which are essential for creating organic electron transport materials. These materials play a significant role in the function of organic light-emitting diodes (OLEDs), which are pivotal in the advancement of new electroluminescent displays and innovative lighting solutions. Furthermore, 2-chloro-4,6-diphenyl-1,3,5-triazine is used in the preparation of organic small molecule electron transport materials, highlighting its importance as an OLED intermediate.
Complexity
249
Covalently-Bonded Unit Count
1
Exact Mass
267.056325g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
19
MDL Number
MFCD05738885
Monoisotopic Mass
267.056325g/mol
NSC Number
231670
Precautionary Statements
P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
Refractive Index
1.57
Rotatable Bond Count
2
Signal Word
Warning
Specific Gravity
1.06
XLogP3
4.3
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