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Basic Information
CAS No.: 263746-45-8
Name: 2'-METHYLPHENYL 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSIDE
Molecular Structure:
Molecular Structure of 263746-45-8 (2'-METHYLPHENYL 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSIDE)
Formula: C15H21NO6
Molecular Weight: 311.33034
Synonyms: 2'-METHYLPHENYL 2-ACETAMIDO-2-DEOXY-SS-D-GLUCOPYRANOSIDE; 2-Methylphenyl2-acetamido-2-deoxy-b-D-glucopyranoside;
Density: 1.348 g/cm3
Boiling Point: 600.411 °C at 760 mmHg
Flash Point: 316.918 °C
PSA: 108.25000
LogP: -0.29160
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Specification

The 2-Methylphenyl 2-acetamido-2-deoxy-beta-D-glucopyranoside, with CAS registry number 263746-45-8, has the systematic name of 2-methylphenyl 2-(acetylamino)-2-deoxy-β-D-glucopyranoside. Besides this, it is also called β-D-glucopyranoside, 2-methylphenyl 2-(acetylamino)-2-deoxy-. And the chemical formula of this chemical is  C15H21NO6.

Physical properties of 2-Methylphenyl 2-acetamido-2-deoxy-beta-D-glucopyranoside: (1)ACD/LogP: -0.05; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 2; (6)ACD/BCF (pH 7.4): 2; (7)ACD/KOC (pH 5.5): 48; (8)ACD/KOC (pH 7.4): 48; (9)#H bond acceptors: 7; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 108.25 Å2; (13)Index of Refraction: 1.592; (14)Molar Refractivity: 78.12 cm3; (15)Molar Volume: 230.951 cm3; (16)Polarizability: 30.969×10-24cm3; (17)Surface Tension: 61.94 dyne/cm; (18)Enthalpy of Vaporization: 93.977 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(=O)N[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2Oc1ccccc1C
(2)InChI: InChI=1/C15H21NO6/c1-8-5-3-4-6-10(8)21-15-12(16-9(2)18)14(20)13(19)11(7-17)22-15/h3-6,11-15,17,19-20H,7H2,1-2H3,(H,16,18)/t11-,12-,13-,14-,15-/m1/s1
(3)InChIKey: FIERZJTVSJNKHH-KJWHEZOQBJ
(4)Std. InChI: InChI=1S/C15H21NO6/c1-8-5-3-4-6-10(8)21-15-12(16-9(2)18)14(20)13(19)11(7-17)22-15/h3-6,11-15,17,19-20H,7H2,1-2H3,(H,16,18)/t11-,12-,13-,14-,15-/m1/s1
(5)Std. InChIKey: FIERZJTVSJNKHH-KJWHEZOQSA-N