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| CAS No.: | 9041-22-9 |
|---|---|
| Name: | beta-D-Glucan |
| Molecular Structure: | |
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| Formula: | (C6H10O5)n |
| Molecular Weight: | 470.42 |
| Synonyms: | beta-Glucan;(2S,3R,4S,6R)-5-[(2S,3R,4S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-oxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,3,4-triol;Biopoly P 3;beta-glucan,oat ,yeast ,oat beta glucan; |
| EINECS: | 232-712-4 |
| Density: | 1.8g/cm3 |
| Boiling Point: | 865.2 °C at 760 mmHg |
| Flash Point: | 477 °C |
| PSA: | 268.68000 |
| LogP: | -7.57300 |
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Specification
The beta-D-Glucan, with cas registry number 9041-22-9, belongs to the following product categories: (1)Carbohydrates; (2)Carbohydrates A to; (3)Carbohydrates GBiochemicals and Reagents; (4)Polysaccharide; (5)Food&Beverage; (6)Kits for Food Analysis; (7)Special Applications. It has the systematic name of beta-D-glucopyranosyl-(1->4)-(4xi)-beta-D-xylo-hexopyranosyl-(1->4)-(4xi)-alpha-D-xylo-hexopyranose. This chemical should store at the temperature of 2-8°C.
Physical properties about this chemical are: (1)ACD/LogP: -3.25; (2)# of Rule of 5 Violations: 3; (3)#H bond acceptors: 16; (4)#H bond donors: 11; (5)#Freely Rotating Bonds: 18; (6)Polar Surface Area: 147.68 Å2; (7)Index of Refraction: 1.673; (8)Molar Refractivity: 104.52 cm3; (9)Molar Volume: 278.7 cm3; (10)Polarizability: 41.43×10-24cm3; (11)Surface Tension: 119.1 dyne/cm; (12)Enthalpy of Vaporization: 142.88 kJ/mol; (13)Vapour Pressure: 6.5E-35 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O[C@H]3C(O[C@@H]2O[C@H](CO)C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H]2O)[C@H](O[C@H](O)[C@@H]3O)CO
(2)InChI: InChI=1/C18H32O16/c19-1-4-7(22)8(23)12(27)17(31-4)34-15-6(3-21)32-18(13(28)10(15)25)33-14-5(2-20)30-16(29)11(26)9(14)24/h4-29H,1-3H2/t4-,5-,6-,7-,8+,9-,10-,11-,12-,13-,14?,15?,16+,17+,18+/m1/s1
(3)InChIKey: FYGDTMLNYKFZSV-URKRLVJHBK
(4)Std. InChI: InChI=1S/C18H32O16/c19-1-4-7(22)8(23)12(27)17(31-4)34-15-6(3-21)32-18(13(28)10(15)25)33-14-5(2-20)30-16(29)11(26)9(14)24/h4-29H,1-3H2/t4-,5-,6-,7-,8+,9-,10-,11-,12-,13-,14?,15?,16+,17+,18+/m1/s1
(5)Std. InChIKey: FYGDTMLNYKFZSV-URKRLVJHSA-N