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119-13-1

Basic Information
CAS No.: 119-13-1
Name: 2H-1-Benzopyran-6-ol,3,4-dihydro-2,8-dimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-, (2R)-
Article Data: 14
Cas Database
Molecular Structure:
Molecular Structure of 119-13-1 (2H-1-Benzopyran-6-ol,3,4-dihydro-2,8-dimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-, (2R)-)
Formula: C27H46O2
Molecular Weight: 402.661
Synonyms: 2H-1-Benzopyran-6-ol,3,4-dihydro-2,8-dimethyl-2-(4,8,12-trimethyltridecyl)-, [2R-[2R*(4R*,8R*)]]-;6-Chromanol, 2,8-dimethyl-2-(4,8,12-trimethyltridecyl)- (8CI);delta-Tocopherol;(R,R,R)-d-Tocopherol;8-Methyltocol;E 309;E-Mix D;78656-14-1;
EINECS: 204-299-0
Density: 0.935 g/cm3
Melting Point: <25℃
Boiling Point: 504.3 °C at 760 mmHg
Flash Point: 200.1 °C
Solubility: N/A
Appearance: clear yellow to brownish viscous liquid
Hazard Symbols: N/A
Risk Codes: N/A
Safety: 24/25
Transport Information: N/A
PSA: 29.46000
LogP: 8.22340
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    Address:5F, Xuxinda Industrial park, Shi yan zhou Road, Baoan District, Shenzhen, China

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  • D-DELTA-TOCOPHEROL

  • Casno:

    119-13-1

    D-DELTA-TOCOPHEROL

    Min.Order: 0

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    Do best quality products, erect the morality model Application:please email us, thanks

    Wuxi Morality Chemical Co., Ltd is specialized in the development and manufacture of industrial additives, bulk chemical intermediates, pharmaceutical raw materials and pesticide

  • Wuxi Morality Chemical Co., Ltd

     China (Mainland)  |  Contact Details

    Business Type:Other

    Tel:+86-510-83597286 17768505220

    Address:B/7F, 321th WuYun Rd, Wanda Plaza, Wuxi City, 214174, China

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  • TOCOPHEROL, D-DELTA

  • Casno:

    119-13-1

    TOCOPHEROL, D-DELTA

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    High pure standard, Quick shippment COA with HPLC, MS and NMR spectra. Application:pharmaceutical industry, food industry, research

    SHANGHAI ZZBIO CO. LTD. is a high-tech enterprise involved in oligosaccharides & polysaccharides, PEG & PEGylation and phytochemicals for customers in pharmaceutical industry, food

  • SHANGHAI ZZBIO CO., LTD.

    China (Mainland)  |  Contact Details

    Business Type:Lab/Research institutions

    Tel:86-21-68404353-215

    Address:Rm 710, 30 BLDG, 2419 Hu Nan RD., Pudong New Area, Shanghai, China

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  • D-DELTA-TOCOPHEROL

  • Casno:

    119-13-1

    D-DELTA-TOCOPHEROL

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    Our company provides the best service for our customers. Under the premise of ensuring quality and delivery date, give customers the best price. The company is more willing to meet our customers. If you want to visit our factories and warehouses, we

  • Sparrow Chemical Co.,Ltd

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    Address:Jinan City,Shandong Province,China

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  • δ-tocopherol

  • Casno:

    119-13-1

    δ-tocopherol

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    FOB Price:  USD $ 0.0-0.0/

    high purity Application:Drug intermediates Materials intermediates and active molecules

    Novachemistry offers a broad range of specialty chemicals and customized synthesis services to a range of pharmaceutical, agrochemical and biochemical industries. Novachemistry has

  • NovaChemistry

    United Kingdom  |  Contact Details

    Business Type:Trading Company

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Specification

The 2H-1-Benzopyran-6-ol,3,4-dihydro-2,8-dimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-, (2R)- is an organic compound with the formula C27H46O2. The IUPAC name of this chemical is (2R)-2,8-dimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-ol. With the CAS registry number 119-13-1, it is also named as . The product's categories are Vitamin E; Vitamin ELipids; Nutrition Research; Prenols; Vitamins. Besides, it is clear yellow to brownish viscous liquid, which should be stored in a closed cool and dry place.

Physical properties about 2H-1-Benzopyran-6-ol,3,4-dihydro-2,8-dimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-, (2R)- are: (1)ACD/LogP: 10.98; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 10.98; (4)ACD/LogD (pH 7.4): 10.98; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 13; (12)Polar Surface Area: 18.46 Å2; (13)Index of Refraction: 1.494; (14)Molar Refractivity: 125.41 cm3; (15)Molar Volume: 430.2 cm3; (16)Polarizability: 49.71×10-24cm3; (17)Surface Tension: 35.1 dyne/cm; (18)Density: 0.935 g/cm3; (19)Flash Point: 200.1 °C; (20)Enthalpy of Vaporization: 80.31 kJ/mol; (21)Boiling Point: 504.3 °C at 760 mmHg; (22)Vapour Pressure: 8.54E-11 mmHg at 25°C.

Uses of 2H-1-Benzopyran-6-ol,3,4-dihydro-2,8-dimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-, (2R)-: it can be used to produce 5-(d-tocopheroxy)-d-tocopherol and 5-[5-(d-tocopheroxy)-d-tocopheroxy]-d-tocopherol at temperature of 37 °C. It will need reagent air and solvent benzene with reaction time of 45 min. The yield is about 77.2%.


You can still convert the following datas into molecular structure:
(1)SMILES: Oc2cc(c1O[C@](CCc1c2)(C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C
(2)InChI: InChI=1/C27H46O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-16-27(6)17-15-24-19-25(28)18-23(5)26(24)29-27/h18-22,28H,7-17H2,1-6H3/t21-,22-,27-/m1/s1
(3)InChIKey: GZIFEOYASATJEH-VHFRWLAGBS
(4)Std. InChI: InChI=1S/C27H46O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-16-27(6)17-15-24-19-25(28)18-23(5)26(24)29-27/h18-22,28H,7-17H2,1-6H3/t21-,22-,27-/m1/s1
(5)Std. InChIKey: GZIFEOYASATJEH-VHFRWLAGSA-N