Benzyl 4,6-O-benzylidene-alpha-D-mannopyranoside supplier

Name
Benzyl 4,6-O-benzylidene-alpha-D-mannopyranoside
EINECS
CAS No. 40983-94-6
Article Data13
CAS DataBase
Density 1.345 g/cm³
Solubility
Melting Point 147-149oC
Formula C₂₀H₂₂O₆
Boiling Point 556.97 °C at 760 mmHg
Molecular Weight 358.391
Flash Point 290.645 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzyl 4-O,6-O-benzylidene-α-D-mannopyranoside;
PSA 77.38000
LogP 1.76410

Benzyl 4,6-O-benzylidene-alpha-D-mannopyranoside Specification

The Benzyl 4,6-O-benzylidene-alpha-D-mannopyranoside with the cas number 40983-94-6 is also called (6R,8R,8aS)-6-benzyloxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine-7,8-diol. Its molecular formula is C₂₀H₂₂O₆. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 0.48; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.481; (4)ACD/LogD (pH 7.4): 0.481; (5)ACD/BCF (pH 5.5): 1.366; (6)ACD/BCF (pH 7.4): 1.366; (7)ACD/KOC (pH 5.5): 43.517; (8)ACD/KOC (pH 7.4): 43.516; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 77.38 Å²; (13)Index of Refraction: 1.626; (14)Molar Refractivity: 94.326 cm³; (15)Molar Volume: 266.39 cm³; (16)Polarizability: 37.394×10^-24cm³; (17)Surface Tension: 60.259 dyne/cm; (18)Enthalpy of Vaporization: 88.246 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1ccc(cc1)CO[C@H]2C([C@H]([C@H]3C(O2)COC(O3)c4ccccc4)O)O
(2)InChI: InChI=1/C20H22O6/c21-16-17(22)20(23-11-13-7-3-1-4-8-13)25-15-12-24-19(26-18(15)16)14-9-5-2-6-10-14/h1-10,15-22H,11-12H2/t15?,16-,17?,18-,19?,20-/m1/s1
(3)InChIKey: LEJLVYJUXVHIJN-IYJWEEFIBQ

Product Name

Benzyl 4,6-O-benzylidene-alpha-D-mannopyranoside

Benzyl 4,6-O-benzylidene-alpha-D-mannopyranoside Specification

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