CAS No.14218-11-2,2,3,4,6-TETRA-O-BENZOYL-ALPHA-D-GLUCOPYRANOSYL BROMIDE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	14218-11-2
Name:	2,3,4,6-TETRA-O-BENZOYL-ALPHA-D-GLUCOPYRANOSYL BROMIDE
Article Data:	54

Formula:	C₃₄H₂₇BrO₉
Molecular Weight:	659.487
Synonyms:	Glucopyranosylbromide, tetrabenzoate (7CI);Glucopyranosyl bromide, tetrabenzoate, a-D- (8CI);a-D-Glucopyranosyl bromide,tetrabenzoate (9CI);2,3,4,6-Tetra-O-benzoyl-a-D-glucopyranosyl bromide;Tetra-O-benzoyl-a-D-glucopyranosyl bromide;
Density:	1.48 g/cm³
Melting Point:	128-131 °C(lit.)
Boiling Point:	729.919 °C at 760 mmHg
Flash Point:	395.241 °C
PSA:	114.43000
LogP:	5.64000

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Specification

This chemical is called α-D-Glucopyranosyl bromide tetrabenzoate, and its systematic name is 2,3,4,6-tetra-O-benzoyl-alpha-D-glucopyranosyl bromide. With the molecular formula of C₃₄H₂₇BrO₉, its product categories are Carbohydrate Synthesis; Monosaccharides; Specialty Synthesis. The CAS registry number of this chemical is 14218-11-2. In addition, this chemical should be sealed in the cool and dry place, away from light.

Other characteristics of the α-D-Glucopyranosyl bromide tetrabenzoate can be summarised as followings: (1)ACD/LogP: 8.52; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 10; (4)ACD/LogD (pH 7.4): 10; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 7909864; (8)ACD/KOC (pH 7.4): 7909864; (9)#H bond acceptors: 9; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 13; (12)Polar Surface Area: 114.43 Å²; (13)Index of Refraction: 1.648; (14)Molar Refractivity: 161.942 cm³; (15)Molar Volume: 445.257 cm³; (16)Polarizability: 64.199×10^-24cm³; (17)Surface Tension: 64.416 dyne/cm; (18)Density: 1.481 g/cm³; (19)Flash Point: 395.241 °C; (20)Enthalpy of Vaporization: 106.546 kJ/mol; (21)Boiling Point: 729.919 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Br[C@H]4O[C@@H]([C@@H](OC(=O)c1ccccc1)[C@H](OC(=O)c2ccccc2)[C@H]4OC(=O)c3ccccc3)COC(=O)c5ccccc5
2.InChI: InChI=1/C34H27BrO9/c35-30-29(44-34(39)25-19-11-4-12-20-25)28(43-33(38)24-17-9-3-10-18-24)27(42-32(37)23-15-7-2-8-16-23)26(41-30)21-40-31(36)22-13-5-1-6-14-22/h1-20,26-30H,21H2/t26-,27-,28+,29-,30+/m1/s1
3.InChIKey: WISFGQOOKBVKPD-RLXMVLCYBS