CAS No.15397-15-6,1,2,3,5-Tetra-O-benzoyl-2-C-methyl-beta-D-ribofuranose Suppliers

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Basic Information

Molecular Structure:
CAS No.:	15397-15-6
Name:	1,2,3,5-Tetra-O-benzoyl-2-C-methyl-beta-D-ribofuranose
Article Data:	6

Formula:	C₃₄H₂₈O₉
Molecular Weight:	580.591
Synonyms:	Ribofuranose,2-C-methyl-, tetrabenzoate, b-D- (8CI);b-D-Ribofuranose,2-C-methyl-, tetrabenzoate (9CI);
EINECS:	604-935-0
Density:	1.34 g/cm³
Melting Point:	154-156 °C
Boiling Point:	687.3 °C at 760 mmHg
Flash Point:	286.7 °C
PSA:	114.43000
LogP:	5.26660

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Specification

The 1,2,3,5-Tetra-O-benzoyl-2-C-methyl-beta-D-ribofuranose, with the CAS registry number 15397-15-6, is also known as 2-C-Methyl-beta-D-ribofuranose 1,2,3,5-tetrabenzoate. This chemical's molecular formula is C₃₄H₂₈O₉ and molecular weight is 580.58. Its systematic name is called 2-C-methyl-1,2,3,5-tetrakis-O-(phenylcarbonyl)-β-D-ribofuranose.

Physical properties about 1,2,3,5-Tetra-O-benzoyl-2-C-methyl-beta-D-ribofuranose are: (1)ACD/LogP: 9.46; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 9.46; (4)ACD/LogD (pH 7.4): 9.46; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 3332008; (8)ACD/KOC (pH 7.4): 3332008; (9)#H bond acceptors: 9; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 13; (12)Index of Refraction: 1.634; (13)Molar Refractivity: 154.26 cm³; (14)Molar Volume: 431.3 cm³; (15)Surface Tension: 61.6 dyne/cm; (16)Density: 1.34 g/cm³; (17)Flash Point: 286.7 °C; (18)Melting Point: 154-156 °C; (19)Enthalpy of Vaporization: 100.76 kJ/mol; (20)Boiling Point: 687.3 °C at 760 mmHg; (21)Vapour Pressure: 9.68E-19 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O[C@@H]3O[C@@H]([C@@H](OC(=O)c1ccccc1)[C@]3(OC(=O)c2ccccc2)C)COC(=O)c4ccccc4)c5ccccc5
(2)InChI: InChI=1/C34H28O9/c1-34(43-32(38)26-20-12-5-13-21-26)28(41-30(36)24-16-8-3-9-17-24)27(22-39-29(35)23-14-6-2-7-15-23)40-33(34)42-31(37)25-18-10-4-11-19-25/h2-21,27-28,33H,22H2,1H3/t27-,28-,33+,34-/m1/s1
(3)InChIKey: QJZSLTLDMBDKOU-VBHQRPIPBQ