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Name |
Glucopyranose,2-acetamido-2-deoxy-6-O-(6-deoxy-a-L-galactopyranosyl)-, D- (8CI) |
EINECS | N/A |
CAS No. | 33639-80-4 | Density | 1.558 g/cm3 |
PSA | 178.17000 | LogP | -3.83490 |
Solubility | N/A | Melting Point |
135-139?C |
Formula | C14H25NO10 | Boiling Point | 736.414 °C at 760 mmHg |
Molecular Weight | 367.353 | Flash Point | 399.169 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
N-[(2R,3S,4R,5S)-2,4,5-Trihydroxy-6-[[(2R,3S,4S,5S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-3-yl]acetamide; |
Article Data | 2 |
The Glucopyranose,2-acetamido-2-deoxy-6-O-(6-deoxy-a-L-galactopyranosyl)-, D- (8CI) is an organic compound with the formula C14H25NO10. The systematic name of this chemical is N-[(2R,3S,4R,5S)-2,4,5-Trihydroxy-6-[[(2R,3S,4S,5S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-3-yl]acetamide. The CAS registry number of this chemical is 33639-80-4. Besides, its molecular weight is 367.35.
The physical properties of Glucopyranose,2-acetamido-2-deoxy-6-O-(6-deoxy-a-L-galactopyranosyl)-, D- (8CI) are: (1)# of Rule of 5 Violations: 2; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 11; (7)#H bond donors: 7; (8)#Freely Rotating Bonds: 10; (9)Polar Surface Area: 178.17 Å2; (10)Index of Refraction: 1.601; (11)Molar Refractivity: 80.762 cm3; (12)Molar Volume: 235.773 cm3; (13)Polarizability: 32.017×10-24 cm3; (14)Surface Tension: 81.277 dyne/cm; (15)Density: 1.558 g/cm3; (16)Flash Point: 399.169 °C; (17)Enthalpy of Vaporization: 122.655 kJ/mol; (18)Boiling Point: 736.414 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: CC1[C@H]([C@@H]([C@@H]([C@@H](O1)OCC2[C@H]([C@@H]([C@@H]([C@@H](O2)O)NC(=O)C)O)O)O)O)O
(2)InChI: InChI=1/C14H25NO10/c1-4-8(17)11(20)12(21)14(24-4)23-3-6-9(18)10(19)7(13(22)25-6)15-5(2)16/h4,6-14,17-22H,3H2,1-2H3,(H,15,16)/t4?,6?,7-,8+,9+,10+,11-,12-,13+,14+/m0/s1
(3)InChIKey: BSNVYGSAFLBSSQ-UCAJAQDNBN
(4)Std. InChI: InChI=1S/C14H25NO10/c1-4-8(17)11(20)12(21)14(24-4)23-3-6-9(18)10(19)7(13(22)25-6)15-5(2)16/h4,6-14,17-22H,3H2,1-2H3,(H,15,16)/t4?,6?,7-,8+,9+,10+,11-,12-,13+,14+/m0/s1
(5)Std. InChIKey: BSNVYGSAFLBSSQ-UCAJAQDNSA-N