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Name |
Methyl 2,3-O-isopropylidene-β-D-ribofuranoside |
EINECS | 223-865-8 |
CAS No. | 4099-85-8 | Density | 1.233 g/cm3 |
PSA | 57.15000 | LogP | -0.12990 |
Solubility | N/A | Melting Point |
N/A |
Formula | C9H16O5 | Boiling Point | 287.258 °C at 760 mmHg |
Molecular Weight | 204.223 | Flash Point | 127.529 °C |
Transport Information | N/A | Appearance | Colourless Liquid |
Safety | Risk Codes | R36/37/38 | |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
Ribofuranoside,methyl 2,3-O-isopropylidene- (6CI,7CI);Ribofuranoside, methyl2,3-O-isopropylidene-, b-D- (8CI);β-D-Ribofuranoside, methyl 2,3-O-(1-methylethylidene)-;NSC 85191; |
Article Data | 134 |
Methyl 2,3-O-isopropylidene-β-D-ribofuranoside is an organic compound with the formula C9H16O5, and its systematic name is the same with the product name. With the CAS registry number 4099-85-8, it is also named as β-D-Ribofuranoside, methyl 2,3-O-(1-methylethylidene)-. It belongs to the product category of Carbohydrates & Derivatives. Its EINECS number is 223-865-8. In addition, the molecular weight is 204.22. This chemical is stable at common pressure and temperature, and it should be sealed and stored in a ventilated and dry place. Moreover, it should be protected from light.
Physical properties of Methyl 2,3-O-isopropylidene-β-D-ribofuranoside are: (1)ACD/LogP: -0.263; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.26; (4)ACD/LogD (pH 7.4): -0.26; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 17.14; (8)ACD/KOC (pH 7.4): 17.14; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 57.15 Å2; (13)Index of Refraction: 1.492; (14)Molar Refractivity: 48.046 cm3; (15)Molar Volume: 165.632 cm3; (16)Polarizability: 19.047×10-24cm3; (17)Surface Tension: 40.53 dyne/cm; (18)Density: 1.233 g/cm3; (19)Flash Point: 127.529 °C; (20)Enthalpy of Vaporization: 61.088 kJ/mol; (21)Boiling Point: 287.258 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O1[C@@H]([C@H]2OC(O[C@H]2[C@@H]1OC)(C)C)CO
(2)Std. InChI: InChI=1S/C9H16O5/c1-9(2)13-6-5(4-10)12-8(11-3)7(6)14-9/h5-8,10H,4H2,1-3H3/t5-,6-,7-,8-/m1/s1
(3)Std. InChIKey: DXBHDBLZPXQALN-WCTZXXKLSA-N