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Name |
Allyl-tetra-O-acetyl-beta-D-glucopyranoside |
EINECS | 1533716-785-6 |
CAS No. | 10343-15-4 | Density | 1.24 g/cm3 |
PSA | 123.66000 | LogP | 0.27210 |
Solubility | N/A | Melting Point |
87-90 °C(lit.) |
Formula | C17H24O10 | Boiling Point | 438.6 °C at 760 mmHg |
Molecular Weight | 388.372 | Flash Point | 189.2 °C |
Transport Information | N/A | Appearance | White to Yellow Conforms to Requirement |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Glucopyranoside,allyl, tetraacetate (7CI);Glucopyranoside, allyl, tetraacetate, b-D- (8CI);b-D-Glucopyranoside, 2-propenyl,tetraacetate (9CI);Allyl 2,3,4,6-teatra-O-acetyl-b-D-glucopyranoside;Allyl 2,3,4,6-tetra-O-acetyl-b-D-glucopyranoside;Allyl-2,3,4,6-tetra-O-acetyl-b-D-glucopyranoside; |
The Allyl-tetra-O-acetyl-beta-D-glucopyranoside, with the CAS registry number 10343-15-4, has the systematic name of prop-2-en-1-yl 2,3,4,6-tetra-O-acetyl-β-D-glucopyranoside. It belongs to the following product categories: Carbohydrate Synthesis; Monosaccharides; Specialty Synthesis. And the molecular formula of the chemical is C17H24O10. What's more, it should be stored in sealed containers, and should keep dry and cool at the same time.
The characteristics of Allyl-tetra-O-acetyl-beta-D-glucopyranoside are as followings: (1)ACD/LogP: 2.11; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 2.11; (4)ACD/LogD (pH 7.4): 2.11; (5)ACD/BCF (pH 5.5): 23.56; (6)ACD/BCF (pH 7.4): 23.56; (7)ACD/KOC (pH 5.5): 334.02; (8)ACD/KOC (pH 7.4): 334.02; (9)#H bond acceptors: 10; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 12; (12)Polar Surface Area: 123.66 Å2; (13)Index of Refraction: 1.483; (14)Molar Refractivity: 89.28 cm3; (15)Molar Volume: 312.6 cm3; (16)Polarizability: 35.39×10-24cm3; (17)Surface Tension: 43.5 dyne/cm; (18)Density: 1.24 g/cm3; (19)Flash Point: 189.2 °C; (20)Enthalpy of Vaporization: 69.54 kJ/mol; (21)Boiling Point: 438.6 °C at 760 mmHg; (22)Vapour Pressure: 6.84E-08 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(OC[C@H]1O[C@@H](OC/C=C)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@@H]1OC(=O)C)C
(2)InChI: InChI=1/C17H24O10/c1-6-7-22-17-16(26-12(5)21)15(25-11(4)20)14(24-10(3)19)13(27-17)8-23-9(2)18/h6,13-17H,1,7-8H2,2-5H3/t13-,14-,15+,16-,17-/m1/s1
(3)InChIKey: CRUHDGOVWKFJBM-NQNKBUKLBP