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15814-59-2

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Basic Information
CAS No.: 15814-59-2
Name: METHYL ALPHA-L-RHAMNOPYRANOSIDE
Article Data: 69
Molecular Structure:
Molecular Structure of 15814-59-2 (METHYL ALPHA-L-RHAMNOPYRANOSIDE)
Formula: C7H14O5
Molecular Weight: 178.185
Synonyms: Mannopyranoside,methyl 6-deoxy-, a-D-(8CI);Methyl 6-deoxy-a-D-mannopyranoside;
Density: 1.32 g/cm3
Boiling Point: 312.6 °C at 760 mmHg
Flash Point: 142.9 °C
PSA: 79.15000
LogP: -1.53970
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Specification

The a-D-Mannopyranoside, methyl6-deoxy-, with the CAS registry number 15814-59-2, is also known as Methyl rhamnopyranoside. This chemical's molecular formula is C7H14O5 and molecular weight is 178.18. What's more, its systematic name is methyl 6-deoxy-α-L-mannopyranoside.

Physical properties about a-D-Mannopyranoside, methyl6-deoxy- are: (1)ACD/LogP: 0.05; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.05; (4)ACD/LogD (pH 7.4): 0.05; (5)ACD/BCF (pH 5.5): 1; (6) ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 25.47; (8)ACD/KOC (pH 7.4): 25.47; (9)#H bond acceptors: 5; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 46.15 Å2; (13)Index of Refraction: 1.513; (14)Molar Refractivity: 40.38 cm3; (15)Molar Volume: 134.3 cm3; (16)Polarizability: 16×10-24cm3; (17)Surface Tension: 52.8 dyne/cm; (18)Density: 1.32 g/cm3; (19)Flash Point: 142.9 °C; (20)Enthalpy of Vaporization: 64.19 kJ/mol; (21)Boiling Point: 312.6 °C at 760 mmHg; (22)Vapour Pressure: 4.59E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O[C@@H]1[C@H](O)[C@@H](O)[C@@H](O[C@H]1OC)C
(2) InChI: InChI=1/C7H14O5/c1-3-4(8)5(9)6(10)7(11-2)12-3/h3-10H,1-2H3/t3-,4-,5+,6+,7+/m0/s1
(3) InChIKey: OHWCAVRRXKJCRB-PAMBMQIZBT