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CAS No.: | 93302-26-2 |
---|---|
Name: | METHYL-D-GALACTOPYRANOSIDE |
Article Data: | 103 |
Molecular Structure: | |
Formula: | C7H14O6 |
Molecular Weight: | 194.185 |
Synonyms: | Galactopyranoside,methyl (6CI);methyl -D-galactopyranoside;Methyl D-galactoside; |
EINECS: | 222-251-7 |
Density: | 1.47 g/cm3 |
Melting Point: | 95-98℃ |
Boiling Point: | 389.1 °C at 760 mmHg |
Flash Point: | 189.1 °C |
PSA: | 99.38000 |
LogP: | -2.56730 |
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The D-Galactopyranoside,methyl, with the CAS registry number 93302-26-2, has the systematic name of methyl D-galactopyranoside. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C7H14O6.
The characteristics of D-Galactopyranoside,methyl are as followings: (1)ACD/LogP: -2.69; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.69; (4)ACD/LogD (pH 7.4): -2.69; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 6; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 55.38 Å2; (13)Index of Refraction: 1.548; (14)Molar Refractivity: 41.92 cm3; (15)Molar Volume: 131.9 cm3; (16)Polarizability: 16.61×10-24cm3; (17)Surface Tension: 68.3 dyne/cm; (18)Density: 1.47 g/cm3; (19)Flash Point: 189.1 °C ; (20) Enthalpy of Vaporization: 73.83 kJ/mol; (21)Boiling Point: 389.1 °C at 760 mmHg; (22)Vapour Pressure: 1.15E-07 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O[C@@H]1[C@@H](O)[C@@H](O)[C@H](O[C@H]1OC)CO
(2)InChI: InChI=1/C7H14O6/c1-12-7-6(11)5(10)4(9)3(2-8)13-7/h3-11H,2H2,1H3/t3-,4+,5+,6-,7-/m1/s1
(3)InChIKey: HOVAGTYPODGVJG-VOQCIKJUBJ