2-(2,4-Dihydroxyphenyl)-4,6-bis(2,4-dimethylphenyl)-1,3,5-triazine
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2-(2,4-Dihydroxyphenyl)-4,6-bis(2,4-dimethylphenyl)-1,3,5-triazine
structure -
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CAS No:
1668-53-7
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Formula:
C25H23N3O2
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Chemical Name:
2-(2,4-Dihydroxyphenyl)-4,6-bis(2,4-dimethylphenyl)-1,3,5-triazine
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Synonyms:
1,3-Benzenediol,4-[4,6-bis(2,4-dimethylphenyl)-1,3,5-triazin-2-yl]-;Resorcinol,4-(4,6-di-2,4-xylyl-s-triazin-2-yl)-;4-[4,6-Bis(2,4-dimethylphenyl)-1,3,5-triazin-2-yl]-1,3-benzenediol;2-(2,4-Dihydroxyphenyl)-4,6-bis(2,4-dimethylphenyl)-1,3,5-triazine;2-(2,4-Dihydroxyphenyl)-4,6-bis-(2,4-dimethylphenyl)-s-triazine;2-(2,4-Dihydroxyphenyl)-4,6-(2,4-dimethylphenyl)-1,3,5-triazine;2,6-Bis(2,4-dimethylphenyl)-4-(2,4-dihydroxyphenyl)-s-triazine;2-[4,6-Bis(2,4-dimethylphenyl)-1,3,5-triazin-2-yl]-5-hydroxyphenol;2,4-Di(2,4-dimethylphenyl)-6-(2,4-dihydroxyphenyl)-triazine
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CAS No:
2-(2,4-Dihydroxyphenyl)-4,6-bis(2,4-dimethylphenyl)-1,3,5-triazine Basic Attributes
397.48
397.47
DTXSID6061866
2933699090
Characteristics
74
3.9
DryPowder
1'+-.0.06 g/cm3(Predicted)
197.5-198.5 °C
659.1±65.0 °C(Predicted)
352.4±34.3 °C
1.637
0mmHg at 25°C
Safety Information
P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
2-(2,4-Dihydroxyphenyl)-4,6-bis(2,4-dimethylphenyl)-1,3,5-triazine Use and Manufacturing
General procedure: To astirred anhydrous chlorobenzene (15 mL) under dry N2 protectionin a 50mL three-necked flask were added 5 (1.6mmol)and anhydrous AlCl3 (0.32 g, 2.4 mmol), the mixture wasstirred for 0.5 h at 25 °C. Then resorcinol (0.24 g, 2.2 mmol)was added, and the mixture was stirred for 5 h at 85 °C. Aftercooling to room temperature, ice water (10 mL) was addedslowly and then chlorobenzene was evaporated under reducedpressure. The mixture was filtered and washed with water(3 × 10 mL), the filter cake was recrystallized with EtOA togive the corresponding products 8a, 8e 9a-9d.EXAMPLE 4 EXAMPLE 6 In a 5-liter three-necked flask equipped with mechanical stirring, 3 liters of chlorobenzene, 184 grams of cyanuric chloride, 212 grams of m-xylene were added(2 times the amount) and 400 g of aluminum trichloride (3 times the amount); under ice-cooling, 20 ml of concentrated hydrochloric acid (0.2 times) was added, the reaction was stirred for 1 hour, and the temperature was raised to room temperature and 121 g of resorcinol was added ( 1.1 times) and then heated to 90°C for 2 hours. After the reaction was completed, the reaction solution was slowly added to 5 liters of 10percent hydrochloric acid with stirring, and the precipitated solid was filtered and washed with water.Recrystallization yielded 365 g (yield 92percent) of 2, 4-bis(m-xylyl)-6-(1-m-xylenol)-1, 3, 5-triazine product.EXAMPLE 7
Intermediates
500,000 - 1,000,000 lb
All other basic organic chemical manufacturing|1,3-Benzenediol, 4-[4,6-bis(2,4-dimethylphenyl)-1,3,5-triazin-2-yl]-: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Computed Properties
Molecular Weight:397.5
XLogP3:5.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:397.17902698
Monoisotopic Mass:397.17902698
Topological Polar Surface Area:79.1
Heavy Atom Count:30
Complexity:527
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-(2,4-Dihydroxyphenyl)-4,6-bis(2,4-dimethylphenyl)-1,3,5-triazine
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