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4-(alpha-Methylbenzyl)resorcinol

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CAS:85-27-8
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CAS:85-27-8
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4-(alpha-Methylbenzyl)resorcinol manufacturers

4-(alpha-Methylbenzyl)resorcinol Basic information
Product Name:4-(alpha-Methylbenzyl)resorcinol
Synonyms:NanoLiposomal 377, NanoLiposomal Phenethyl Resorcinol;Nanoactive Phenylethyl Resorcinol;LGB-PR;4-(alpha-Methylbenzyl)resorcinol;4-(1-Phenylethyl)resorcin;4-(1-Phenylethyl)resorcinol;1,3-Benzenediol, 4-(1-phenylethyl)-;4-(1-phenylethy)-1,3-benzenediol
CAS:85-27-8
MF:C14H14O2
MW:214.26
EINECS:480-070-0
Product Categories:OLED materials,pharm chemical,electronic;PP;85-27-8
Mol File:85-27-8.mol
4-(alpha-Methylbenzyl)resorcinol Structure
4-(alpha-Methylbenzyl)resorcinol Chemical Properties
Melting point 78-79℃
Boiling point 244°C/12mmHg(lit.)
density 1.171
vapor pressure 0Pa at 20℃
storage temp. Inert atmosphere,Room Temperature
solubility Chloroform (Slightly), Ethyl Acetate (Slightly)
form Solid
pka9.77±0.40(Predicted)
color Light Beige to Pale Brown
Water Solubility 3.85g/L at 20℃
Cosmetics Ingredients FunctionsANTIOXIDANT
InChIInChI=1S/C14H14O2/c1-10(11-5-3-2-4-6-11)13-8-7-12(15)9-14(13)16/h2-10,15-16H,1H3
InChIKeyPQSXNIMHIHYFEE-UHFFFAOYSA-N
SMILESC1(O)=CC=C(C(C2=CC=CC=C2)C)C(O)=C1
LogP2.11 at 22℃
Safety Information
HS Code 2907290090
MSDS Information
4-(alpha-Methylbenzyl)resorcinol Usage And Synthesis
Uses4-(1-Phenylethyl)-1,3-benzenediol is an novel active ingredient of highly efficient skin lightening agents.
Flammability and ExplosibilityNon flammable
Synthesis
1,2-Ethanediyl, 1-phenyl- (9CI)

292638-84-7

Resorcinol

108-46-3

4-(alpha-Methylbenzyl)resorcinol

85-27-8

1) Under nitrogen protection, 231 g (2.1 mol) of resorcinol, 4.62 g of the solid acid H2SO4-SiO2, and 220 mL of toluene were added to a reactor, heated to 95 °C, and maintained at that temperature. Subsequently, 104 g (1 mol) of styrene was slowly added dropwise to the reactor at a controlled rate for 1 hour. After completion of the dropwise addition, the reaction was continued at 95 °C for 1 h to obtain the reaction mixture. 2) After completion of the reaction, the reaction mixture was filtered to remove the solid acid H2SO4-SiO2. 150 mL of 0.5% aqueous sodium bicarbonate was added to the filtrate for extraction to separate the organic phase. The organic phase was washed twice more (150 mL each) with deionized water. The organic phase was collected and toluene was removed by rotary evaporator. Subsequently, 250 mL of a mixed solution of hexane and toluene (1:5, v/v) was added for recrystallization, and 177.6 g of white crystal product was obtained in 83% yield.

References[1] Patent: CN105237359, 2016, A. Location in patent: Paragraph 0038; 0039; 0040; 0041; 0042; 0043; 0044
[2] DRP/DRBP Org.Chem.,
[3] Journal of Organic Chemistry, 1952, vol. 17, p. 243,247
[4] Bulletin of the Chemical Society of Japan, 1995, vol. 68, # 10, p. 2955 - 2960
4-(alpha-Methylbenzyl)resorcinol Preparation Products And Raw materials
Raw materials1,2-Ethanediyl, 1-phenyl- (9CI)-->Resorcinol-->Toluene
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