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13392-26-2

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Basic Information
CAS No.: 13392-26-2
Name: (+/-)-EPICATECHIN
Article Data: 16
Molecular Structure:
Molecular Structure of 13392-26-2 ((+/-)-EPICATECHIN)
Formula: C15H14O6
Molecular Weight: 290.273
Synonyms: 3,3',4',5,7-Flavanpentol(7CI,8CI);
EINECS: 236-471-6
Density: 1.593 g/cm3
Melting Point: 240 °C (decomp)
Boiling Point: 630.4 °C at 760 mmHg
Flash Point: 335 °C
PSA: 110.38000
LogP: 1.54610
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  • 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-

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    13392-26-2

    2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-

    Min.Order: 10 Gram

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    Zibo Hangyu Biotechnology Development Co., Ltd is a leading manufacturer and supplier of chemicals in China. We develop produce and distribute high quality pharmaceuticals, intermediates, special chemicals and OLED intermediates and other fine chemi

    Hangyu Biotech is a leading manufacturer and supplier of chemicals in China. We develop produce and distribute high quality pharmaceuticals, intermediates, special chemicals and O

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  • 13392-26-2

  • Casno:

    13392-26-2

    13392-26-2

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    High quality,stable supply chain.Appearance:white/off-white or light yellow Storage:Store in cool and dry place, keep away from strong light and heat. Package:aluminum bottle,glass bottle,PTFE bottle,cardboard drum Application:This product can be use

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  • (+/-)-EPICATECHIN

  • Casno:

    13392-26-2

    (+/-)-EPICATECHIN

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    factory?direct?saleAppearance:White powder Storage:Sealed and preserved Package:200/Kilograms Application:healing drugs Transportation:By sea Port:Shanghai/tianjin

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Specification

The 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro- is an organic compound with the formula C15H14O6. The IUPAC name of this chemical is 2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-4,5,7-triol. With the CAS registry number 13392-26-2, it is also named as 3',4',5,7-Tetrahydroxyflavan-3-ol.

Physical properties about 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro- are: (1)ACD/LogP: 0.49; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 0.49; (4)ACD/LogD (pH 7.4): 0.48; (5)ACD/BCF (pH 5.5): 1.39; (6)ACD/BCF (pH 7.4): 1.36; (7)ACD/KOC (pH 5.5): 44.03; (8)ACD/KOC (pH 7.4): 42.96; (9)#H bond acceptors: 6; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 55.38 Å2; (13)Index of Refraction: 1.741; (14)Molar Refractivity: 73.59 cm3; (15)Molar Volume: 182.1 cm3; (16)Polarizability: 29.17×10-24cm3; (17)Surface Tension: 88.1 dyne/cm; (18)Density: 1.593 g/cm3; (19)Flash Point: 335 °C; (20)Enthalpy of Vaporization: 98.01 kJ/mol; (21)Boiling Point: 630.4 °C at 760 mmHg; (22)Vapour Pressure: 9.29E-17 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccc(cc1O)C3Oc2cc(O)cc(O)c2CC3O
(2)InChI: InChI=1/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2
(3)InChIKey: PFTAWBLQPZVEMU-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2
(5)Std. InChIKey: PFTAWBLQPZVEMU-UHFFFAOYSA-N