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CAS No.: | 5579-66-8 |
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Name: | Decaethylene glycol |
Article Data: | 11 |
Molecular Structure: | |
Formula: | C20H42O11 |
Molecular Weight: | 458.547 |
Synonyms: | Decaethyleneglycol (7CI,8CI);Decaethylene glycol;2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol; |
EINECS: | 226-962-3 |
Density: | 1.115 g/cm3 |
Melting Point: | 28 °C |
Boiling Point: | 539.5 °C at 760 mmHg |
Flash Point: | 280.1 °C |
PSA: | 123.53000 |
LogP: | -0.87960 |
The CAS register number of Decaethylene glycol is 5579-66-8. It also can be called as 3,6,9,12,15,18,21,24,27-Nonaoxanonacosane-1,29-diol and the IUPAC name about this chemical is 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol. The molecular formula about this chemical is C20H42O11 and the molecular weight is 458.54. It belongs to the following product categories which include Ethylene Glycols; Ethylene Glycols & Monofunctional Ethylene Glycols and so on.
Physical properties about Decaethylene glycol are: (1)ACD/LogP: -4.38; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -4.38; (4)ACD/LogD (pH 7.4): -4.38; (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: 11; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 30; (12)Polar Surface Area: 101.53Å2; (13)Index of Refraction: 1.464; (14)Molar Refractivity: 113.48 cm3; (15)Molar Volume: 410.9 cm3; (16)Polarizability: 44.98x10-24cm3; (17)Surface Tension: 40.7 dyne/cm; (18)Enthalpy of Vaporization: 93.94 kJ/mol; (19)Boiling Point: 539.5 °C at 760 mmHg; (20)Vapour Pressure: 6.89E-14 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O(CCOCCOCCO)CCOCCOCCOCCOCCOCCOCCO
(2)InChI: InChI=1/C20H42O11/c21-1-3-23-5-7-25-9-11-27-13-15-29-17-19-31-20-18-30-16-14-28-12-10-26-8-6-24-4-2-22/h21-22H,1-20H2
(3)InChIKey: DTPCFIHYWYONMD-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C20H42O11/c21-1-3-23-5-7-25-9-11-27-13-15-29-17-19-31-20-18-30-16-14-28-12-10-26-8-6-24-4-2-22/h21-22H,1-20H2
(5)Std. InChIKey: DTPCFIHYWYONMD-UHFFFAOYSA-N