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| CAS No.: | 624-04-4 |
|---|---|
| Name: | ETHYLENE GLYCOL DILAURATE |
| Molecular Structure: | |
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| Formula: | C26H50O4 |
| Molecular Weight: | 426.681 |
| Synonyms: | Dodecanoicacid, 1,2-ethanediyl ester (9CI);Lauric acid, ethylene ester (6CI,7CI,8CI);Ethylene glycol, dilaurate (8CI);Ethylene dilaurate;Ethylene glycoldidodecanoate;Ethylene laurate;Glycol dilaurate;NSC 406565; |
| EINECS: | 210-827-0 |
| Density: | 0.918 g/cm3 |
| Melting Point: | 50-52° |
| Boiling Point: | 495.6 °C at 760 mmHg |
| Flash Point: | 231.9 °C |
| PSA: | 52.60000 |
| LogP: | 7.91460 |
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Specification
This chemical is called Dodecanoic acid, 1,1'-(1,2-ethanediyl) ester, and it can also be named as Ethylene glycol dilaurate. With the molecular formula of C26H50O4, its molecular weight is 426.67. The CAS registry number of this chemical is 624-04-4.
Other characteristics of the Dodecanoic acid, 1,1'-(1,2-ethanediyl) ester can be summarised as followings: (1)ACD/LogP: 10.57; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 10.57; (4)ACD/LogD (pH 7.4): 10.57; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 25; (12)Polar Surface Area: 52.6 Å2; (13)Index of Refraction: 1.454; (14)Molar Refractivity: 126.05 cm3; (15)Molar Volume: 464.6 cm3; (16)Polarizability: 49.97×10-24cm3; (17)Surface Tension: 33.2 dyne/cm; (18)Density: 0.918 g/cm3; (19)Flash Point: 231.9 °C; (20)Enthalpy of Vaporization: 76.32 kJ/mol; (21)Boiling Point: 495.6 °C at 760 mmHg; (22)Vapour Pressure: 5.81E-10 mmHg at 25°C.
Production method of this chemical: The Dodecanoic acid, 1,1'-(1,2-ethanediyl) ester could be obtained by the reactants of ethane-1,2-diol and dodecanoic acid. This reaction needs the reagent of DCC, 4-dimethylaminopyridine.
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You can still convert the following datas into molecular structure:
1.SMILES: O=C(OCCOC(=O)CCCCCCCCCCC)CCCCCCCCCCC
2.InChI: InChI=1/C26H50O4/c1-3-5-7-9-11-13-15-17-19-21-25(27)29-23-24-30-26(28)22-20-18-16-14-12-10-8-6-4-2/h3-24H2,1-2H3
3.InChIKey: ZVUNTIMPQCQCAQ-UHFFFAOYAG