Molecular structure of Methyl 2,3,4-triacetate-alpha-D-glucopyranoside (CAS NO.7432-72-6) is:
Product Name: Methyl 2,3,4-triacetate-alpha-D-glucopyranoside
CAS Registry Number: 7432-72-6
IUPAC Name: [(2R,3R,4S,5R)-4,5-diacetyloxy-2-(hydroxymethyl)-6-methoxyoxan-3-yl] acetate
Molecular Weight: 320.2925 [g/mol]
Molecular Formula: C13H20O9
XLogP3-AA: -0.9
H-Bond Donor: 1
H-Bond Acceptor: 9
Index of Refraction: 1.484
Molar Refractivity: 70.67 cm3
Molar Volume: 246.9 cm3
Surface Tension: 46.5 dyne/cm
Density: 1.29 g/cm3
Flash Point: 136.5 °C
Enthalpy of Vaporization: 73.89 kJ/mol
Boiling Point: 389.6 °C at 760 mmHg
Vapour Pressure: 1.11E-07 mmHg at 25 °C
Product Categories: Sugars
Canonical SMILES: CC(=O)OC1C(OC(C(C1OC(=O)C)OC(=O)C)OC)CO
Isomeric SMILES: CC(=O)O[C@@H]1[C@H](OC([C@@H]([C@H]1OC(=O)C)OC(=O)C)OC)CO
InChI: InChI=1S/C13H20O9/c1-6(15)19-10-9(5-14)22-13(18-4)12(21-8(3)17)11(10)20-7(2)16/h9-14H,5H2,1-4H3/t9-,10-,11+,12-,13?/m1/s1
InChIKey: OBVFJYUDIWPVKD-HENWMNBSSA-N
Methyl 2,3,4-triacetate-alpha-D-glucopyranoside , its cas register number is 7432-72-6. It also can be called Methyl 2,3,4-tri-O-acetylglucopyranoside ; M-2,3,4-Aaglu ; alpha-D-Glucopyranoside, methyl, 2,3,4-triacetate .
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