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709-50-2

Basic Information
CAS No.: 709-50-2
Name: Methyl beta-D-glucopyranoside
Article Data: 198
Molecular Structure:
Molecular Structure of 709-50-2 (Methyl beta-D-glucopyranoside)
Formula: C7H14O6
Molecular Weight: 194.185
Synonyms: Glucopyranoside,methyl, b-D- (8CI);1-O-Methyl-b-D-glucopyranoside;Methyl b-D-glucopyranoside;NSC 403457;methyl hexopyranoside;2-(hydroxymethyl)-6-methoxyoxane-3,4,5-triol;hexopyranoside, methyl;Methyl hexopyranoside;
EINECS: 211-909-9
Density: 1.47 g/cm3
Melting Point: 107-111ºC
Boiling Point: 389.1 °C at 760 mmHg
Flash Point: 189.1 °C
Solubility: 0.1 g/mL, clear, colorless in water
Appearance: White Cyrstalline Solid
Safety: 24/25
PSA: 99.38000
LogP: -2.56730
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  • Methyl beta-D-glucopyranoside cas  709-50-2

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  • b-D-Glucopyranoside, methyl

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    709-50-2

    b-D-Glucopyranoside, methyl

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    709-50-2 Application:intermediate

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    709-50-2

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  • METHYL BETA-D-GLUCOPYRANOSIDE

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    709-50-2

    METHYL BETA-D-GLUCOPYRANOSIDE

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Specification

The β-D-Glucopyranoside, methyl, with cas registry number of 709-50-2 and EINECS registry number 211-909-9, has the systematic name of methyl hexopyranoside. It is a kind of white cyrstalline solid, and belongs to the following product categories: Biochemistry; Glucose; Glycosides; Sugars; Carbohydrates & Derivatives. And the molecular formula of the chemical is C7H14O6.

The characteristics of β-D-Glucopyranoside, methyl are as followings: (1)ACD/LogP: -2.69; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.69; (4)ACD/LogD (pH 7.4): -2.69; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 6; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 55.38 Å2; (13)Index of Refraction: 1.548; (14)Molar Refractivity: 41.92 cm3; (15)Molar Volume: 131.9 cm3; (16)Polarizability: 16.61×10-24cm3; (17)Surface Tension: 68.3 dyne/cm; (18)Density: 1.47 g/cm3; (19)Flash Point: 189.1 °C; (20)Enthalpy of Vaporization: 73.83 kJ/mol; (21)Boiling Point: 389.1 °C at 760 mmHg; (22)Vapour Pressure: 1.15E-07 mmHg at 25°C. 

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: OC1C(O)C(O)C(OC1OC)CO
(2)InChI: InChI=1/C7H14O6/c1-12-7-6(11)5(10)4(9)3(2-8)13-7/h3-11H,2H2,1H3
(3)InChIKey: HOVAGTYPODGVJG-UHFFFAOYAM