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27113-22-0

Basic Information
CAS No.: 27113-22-0
Name: 6-Paradol
Molecular Structure:
Molecular Structure of 27113-22-0 (6-Paradol)
Formula: C17H26O3
Molecular Weight: 278.38654
Synonyms: Heptyl4-hydroxy-3-methoxyphenethyl ketone;Paradol;[6]-Gingerone;[6]-Paradol;3-Decanone,1-(4-hydroxy-3-methoxyphenyl)-;
EINECS: 248-228-1
Density: 1.016 g/cm3
Melting Point:
Boiling Point: 406.4 °C at 760 mmHg
Flash Point: 140 °C
Solubility:
Appearance:
Hazard Symbols:
Risk Codes:
Safety:
Transport Information:
PSA: 46.53000
LogP: 4.26300
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  • Casno:

    27113-22-0

    High Quality 6-Paradol Powder CAS 27113-22-0

    Min.Order: 1 Kilogram

    FOB Price:  USD $ 0.0-0.0/Kilogram

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  • Pharmaceutical Raw Material CAS 27113-22-0 6-Paradol 50%

  • Casno:

    27113-22-0

    Pharmaceutical Raw Material CAS 27113-22-0 6-Paradol 50%

    Min.Order: 1 Kilogram

    FOB Price:  USD $ 530.0-555.0/Kilogram

    Wuhan Senwayer century chemical Co..Ltd located in the predominant Wuhan City where is a traffic hinge of China, specialize in producing and developing pharmaceutical & its intermediates, Pesticide Intermediate, food additive, Plant extract

    Wuhan senwayer century chemical Co.,Ltd located in the predominant WuHan City where is a traffic hinge of China,specilize in producing and developing pharmaceutical & its intermedi

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     China (Mainland)  |  Contact Details

    Business Type:Trading Company

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  • High quality 6 Paradol

  • Casno:

    27113-22-0

    High quality 6 Paradol

    Min.Order: 1 Kilogram

    FOB Price:  USD $ 1.0-1.0/Kilogram

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  • High Quality 6-Paradol

  • Casno:

    27113-22-0

    High Quality 6-Paradol

    Min.Order: 1 Kilogram

    FOB Price:  USD $ 100.0-100.0/Kilogram

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    China (Mainland)  |  Contact Details

    Business Type:Lab/Research institutions

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  • 1-(4-hydroxy-3-methoxyphenyl)decan-3-one

  • Casno:

    27113-22-0

    1-(4-hydroxy-3-methoxyphenyl)decan-3-one

    Min.Order: 1 Gram

    FOB Price:  USD $ 10.0-10.0/Gram

    Superiority: Zhejiang J&C Biological Technology Co., Limited is specialized in the production of high complex new type intermediates and chemical custom synthesis, scale-up production and rare chemicals trade. Products category is including I

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    Business Type:Trading Company

    Tel:0570-4045877

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  • 6-paradol

  • Casno:

    27113-22-0

    6-paradol

    Min.Order: 0 Metric Ton

    FOB Price:  USD $ 0.0-0.0/Metric Ton

    The quality is guaranteed. If you find the product is wrong compared with COA, we promise 100% refund or change product. COA and HPLC will be shipped out with goods. You can also inform your analysis method and we will follow your analysis me

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     China (Mainland)  |  Contact Details

    Business Type:Manufacturers

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  • 6-Paradol

  • Casno:

    27113-22-0

    6-Paradol

    Min.Order: 500 Gram

    FOB Price:  USD $ 1.0-1.1/Gram

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    Tel:+86-0311-89278944

    Address:hebei

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Specification

The 6-Paradol, with the CAS registry number 27113-22-0, is also known as 3-Decanone, 1-(4-hydroxy-3-methoxyphenyl)-. Its EINECS registry number is 248-228-1. This chemical's molecular formula is C17H26O3 and molecular weight is 278.38654. What's more, its IUPAC name is 1-(4-Hydroxy-3-methoxyphenyl)decan-3-one. This chemical's classification code is Drug / Therapeutic Agent. In addition, 6-Paradol is the active flavor constituent of the seeds of Guinea pepper (Aframomum melegueta). And the seed is also known as Grains of paradise. Besides, this chemical has been found to have antioxidative and antitumor promoting effects. And it is used in flavors as an essential oil to give spiciness.

Physical properties about 6-Paradol are: (1)ACD/LogP: 3.83; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.83; (4)ACD/LogD (pH 7.4): 3.83; (5)ACD/BCF (pH 5.5): 477.52; (6)ACD/BCF (pH 7.4): 476.4; (7)ACD/KOC (pH 5.5): 2878.87; (8)ACD/KOC (pH 7.4): 2872.13; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 11; (12)Polar Surface Area: 35.53 Å2; (13)Index of Refraction: 1.506; (14)Molar Refractivity: 81.45 cm3; (15)Molar Volume: 273.8 cm3; (16)Polarizability: 32.29×10-24 cm3; (17)Surface Tension: 37.7 dyne/cm; (18)Density: 1.016 g/cm3; (19)Flash Point: 140 °C; (20)Enthalpy of Vaporization: 68.38 kJ/mol; (21)Boiling Point: 406.4 °C at 760 mmHg; (22)Vapour Pressure: 3.46E-07 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(CCCCCCC)CCc1cc(OC)c(O)cc1
(2) InChI: InChI=1/C17H26O3/c1-3-4-5-6-7-8-15(18)11-9-14-10-12-16(19)17(13-14)20-2/h10,12-13,19H,3-9,11H2,1-2H3
(3) InChIKey: CZNLTCTYLMYLHL-UHFFFAOYAE

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 270mg/kg (270mg/kg)   Journal of Toxicological Sciences. Vol. 16(Suppl,

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