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82494-09-5

Basic Information
CAS No.: 82494-09-5
Name: N-DECYL-BETA-D-MALTOPYRANOSIDE
Article Data: 10
Molecular Structure:
Molecular Structure of 82494-09-5 (N-DECYL-BETA-D-MALTOPYRANOSIDE)
Formula: C22H42O11
Molecular Weight: 482.569
Synonyms: Decyl b-D-maltoside;1-Decylb-D-maltoside;1-O-Decyl-b-D-maltoside;Decyl b-D-maltopyranoside;Decyl b-maltopyranoside;Decyl-b-maltoside;Decylmaltoside;n-Decyl b-D-maltoside;n-Decyl-b-D-maltopyranoside;decyl 4-O-alpha-D-glucopyranosyl-beta-D-glucopyranoside;Decyl 4-O-α-D-glucopyranosyl-β-D-glucopyranoside;Decyl β-D-maltopyranoside;Decyl-β-D-maltoside;Decyl-β-D-maltoside 10 mM solution;
EINECS: 231-791-2
Density: 1.32 g/cm3
Boiling Point: 689.4 °C at 760 mmHg
Flash Point: 370.8 °C
Solubility: H2O: 50 mg/mL, clear
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-37/39
PSA: 178.53000
LogP: -1.23220
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Specification

The β-D-Glucopyranoside, decyl 4-O-α-D-glucopyranosyl-, with the CAS registry number 82494-09-5, has the systematic name of decyl 4-O-alpha-D-glucopyranosyl-beta-D-glucopyranoside. It should be stored at 2-8°C. And the molecular formula of the chemical is C22H42O11.

The characteristics of β-D-Glucopyranoside, decyl 4-O-α-D-glucopyranosyl- are as followings: (1)ACD/LogP: 1.63; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 1.62; (4)ACD/LogD (pH 7.4): 1.62; (5)ACD/BCF (pH 5.5): 10.11; (6)ACD/BCF (pH 7.4): 10.11; (7)ACD/KOC (pH 5.5): 182.36; (8)ACD/KOC (pH 7.4): 182.35; (9)#H bond acceptors: 11; (10)#H bond donors: 7; (11)#Freely Rotating Bonds: 21; (12)Polar Surface Area: 101.53 Å2; (13)Index of Refraction: 1.558; (14)Molar Refractivity: 117.32 cm3; (15)Molar Volume: 363.8 cm3; (16)Polarizability: 46.5×10-24cm3; (17)Surface Tension: 64.8 dyne/cm; (18)Density: 1.32 g/cm3; (19)Flash Point: 370.8 °C; (20)Enthalpy of Vaporization: 115.56 kJ/mol; (21)Boiling Point: 689.4 °C at 760 mmHg; (22)Vapour Pressure: 5.36E-22 mmHg at 25°C. 

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

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](OCCCCCCCCCC)O[C@@H]1CO)[C@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)CO
(2)InChI: InChI=1/C22H42O11/c1-2-3-4-5-6-7-8-9-10-30-21-19(29)17(27)20(14(12-24)32-21)33-22-18(28)16(26)15(25)13(11-23)31-22/h13-29H,2-12H2,1H3/t13-,14-,15-,16+,17-,18-,19-,20-,21-,22-/m1/s1
(3)InChIKey: WOQQAWHSKSSAGF-WXFJLFHKBS