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CAS No.: | 5353-27-5 |
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Name: | OLETH-5 |
Molecular Structure: | |
Formula: | C28H56O6 |
Molecular Weight: | 488.41 |
Synonyms: | SINOPOL 1205;3,6,9,12,15-pentaoxatritriacont-24-en-1-ol, (24Z)-; |
Density: | 0.951 g/cm3 |
Boiling Point: | 557.788 °C at 760 mmHg |
Flash Point: | 291.14 °C |
(24Z)-3,6,9,12,15-Pentaoxatritriacont-24-en-1-ol is an organic compound with the formula C28H56O6, and its systematic name is the same with the product name. With the CAS registry number 5353-27-5, it is also named as 3,6,9,12,15-pentaoxatritriacont-24-en-1-ol, (24Z)-. In addition, the molecular weight is 488.41.
Physical properties of (24Z)-3,6,9,12,15-Pentaoxatritriacont-24-en-1-ol are: (1)ACD/LogP: 6.285; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.29; (4)ACD/LogD (pH 7.4): 6.29; (5)ACD/BCF (pH 5.5): 35184.62; (6)ACD/BCF (pH 7.4): 35184.62; (7)ACD/KOC (pH 5.5): 62497.57; (8)ACD/KOC (pH 7.4): 62497.57; (9)#H bond acceptors: 6; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 31; (12)Polar Surface Area: 66.38 Å2; (13)Index of Refraction: 1.465; (14)Molar Refractivity: 142.088 cm3; (15)Molar Volume: 513.657 cm3; (16)Polarizability: 56.328×10-24cm3; (17)Surface Tension: 34.89 dyne/cm; (18)Density: 0.951 g/cm3; (19)Flash Point: 291.14 °C; (20)Enthalpy of Vaporization: 96.493 kJ/mol; (21)Boiling Point: 557.788 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CCCCCCCC/C=C\CCCCCCCCOCCOCCOCCOCCOCCO
(2)Std. InChI: InChI=1S/C28H56O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-30-21-23-32-25-27-34-28-26-33-24-22-31-20-18-29/h9-10,29H,2-8,11-28H2,1H3/b10-9-
(3)Std. InChIKey: SPERQHYLCADTJF-KTKRTIGZSA-N