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CAS No.: | 612-05-5 |
---|---|
Name: | METHYL-BETA-D-XYLOPYRANOSIDE |
Article Data: | 112 |
Molecular Structure: | |
Formula: | C6H12O5 |
Molecular Weight: | 164.158 |
Synonyms: | Methyl β-D-xylopyranoside; |
EINECS: | 210-289-7 |
Density: | 1.4 g/cm3 |
Melting Point: | 155-158 °C |
Boiling Point: | 314 °C at 760 mmHg |
Flash Point: | 143.7 °C |
Solubility: | almost transparency in Water |
Appearance: | white to off-white crystalline powder |
PSA: | 79.15000 |
LogP: | -1.92820 |
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The beta-D-Xylopyranoside, methyl, with the CAS registry number of 612-05-5, is also known as Methyl β-D-xylopyranoside. It belongs to the product categories of Carbohydrates; Carbohydrates A to; Carbohydrates M-OBiochemicals and Reagents; Monosaccharide. Its EINECS registry number is 210-289-7. This chemical's molecular formula is C6H12O5 and molecular weight is 164.16. What's more, its IUPAC name is 2-Methoxyoxane-3,4,5-triol. In addition, it must be stored in airtight containers. It is used for biochemical studies.
Physical properties about the beta-D-Xylopyranoside, methyl are: (1)ACD/LogP: -1.63; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 79.15 Å2; (7)Index of Refraction: 1.522; (8)Molar Refractivity: 35.776 cm3; (9)Molar Volume: 117.257 cm3; (10)Surface Tension: 58.474 dyne/cm; (11)Density: 1.4 g/cm3; (12)Flash Point: 143.674 °C; (13)Enthalpy of Vaporization: 64.356 kJ/mol; (14)Boiling Point: 313.953 °C at 760 mmHg; (15)Vapour Pressure: 0 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)CO[C@H]1OC
(2) InChI: InChI=1/C6H12O5/c1-10-6-5(9)4(8)3(7)2-11-6/h3-9H,2H2,1H3/t3-,4+,5-,6-/m1/s1
(3) InChIKey: ZBDGHWFPLXXWRD-JGWLITMVBP