Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
D-Mannopyranose, 1,2,3,4,6-pentaacetate |
EINECS | N/A |
CAS No. | 25941-03-1 | Density | 1.31 g/cm3 |
PSA | 140.73000 | LogP | -0.36740 |
Solubility | N/A | Melting Point |
68-70°C |
Formula | C16H22O11 | Boiling Point | 434.77 °C at 760 mmHg |
Molecular Weight | 390.344 | Flash Point | 188.052 °C |
Transport Information | N/A | Appearance | white to off-white solid |
Safety | 24/25 | Risk Codes | N/A |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
D-Mannopyranose,pentaacetate (9CI);Mannopyranose, pentaacetate, D- (8CI);1,2,3,4,6-Penta-O-acetyl-D-mannopyranose; |
Article Data | 9 |
This chemical is called D-Mannopyranose, 1,2,3,4,6-pentaacetate, and it can also be named as 1,2,3,4,6-Penta-O-acetyl-D-mannopyranose. With the molecular formula of C16H22O11, its CAS registry number is 25941-03-1. Additionally, it's white to off-white solid. Its product categories are Carbohydrates & Derivatives; Carbohydrates.
Other characteristics of the D-Mannopyranose, 1,2,3,4,6-pentaacetate can be summarised as followings: (1)ACD/LogP: 0.63; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 0.634; (4)ACD/LogD (pH 7.4): 0.634; (5)ACD/BCF (pH 5.5): 1.786; (6)ACD/BCF (pH 7.4): 1.786; (7)ACD/KOC (pH 5.5): 52.721; (8)ACD/KOC (pH 7.4): 52.721; (9)#H bond acceptors: 11; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 11; (12)Polar Surface Area: 140.73 Å2; (13)Index of Refraction: 1.482; (14)Molar Refractivity: 85.001 cm3; (15)Molar Volume: 298.019 cm3; (16)Polarizability: 33.697×10-24cm3; (17)Surface Tension: 46.708 dyne/cm; (18)Density: 1.31 g/cm3; (19)Flash Point: 188.052 °C; (20)Enthalpy of Vaporization: 69.094 kJ/mol; (21)Boiling Point: 434.77 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: CC(=O)OC[C@H]1C([C@@H]([C@H]([C@@H](O1)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
2.InChI: InChI=1/C16H22O11/c1-7(17)22-6-12-13(23-8(2)18)14(24-9(3)19)15(25-10(4)20)16(27-12)26-11(5)21/h12-16H,6H2,1-5H3/t12-,13?,14-,15+,16+/m0/s1
3.InChIKey: LPTITAGPBXDDGR-NIOBXDJOBH