| Identification | |
| Name: | Phenol,2-methyl-4,6-bis[(octylthio)methyl]- |
| Synonyms: | 2,4-Bis(octylthiomethyl)-6-methylphenol;2,4-Dioctylthiomethyl-6-methylphenol;4,6-Bis(octylthiomethyl)-o-cresol;AO 4 (Russian stabilizer);Antioxidant2088;EB 51-677;Irganox 1520;Irganox 1520L;Irganox 1520SE;Irgastab Cable KV10;KV 10; |
| CAS: | 110553-27-0 |
| EINECS: | 402-860-6 |
| Molecular Formula: | C25H44OS2 |
| Molecular Weight: | 424.74626 |
| InChI: | InChI=1S/C25H44OS2/c1-4-6-8-10-12-14-16-27-20-23-18-22(3)25(26)24(19-23)21-28-17-15-13-11-9-7-5-2/h18-19,26H,4-17,20-21H2,1-3H3 |
| Molecular Structure: |  |
| Properties | |
| Density: | 0.99 g/cm3 |
| Refractive index: | 1.532 |
| Water Solubility: | Insoluble in water, easily soluble in acetone, and soluble in ethanol |
| Solubility: | Insoluble in water, easily soluble in acetone, and soluble in ethanol |
| Specification: |
The IUPAC name of this chemical is 2-methyl-4,6-bis(octylsulfanylmethyl)phenol. With the CAS registry number 110553-27-0, it is also named as Phenol, 2-methyl-4,6-bis((octylthio)methyl)-. The product's categorie is benzene. And the other registry number is 224778-45-4. 2-Methyl-4,6-bis((octylthio)methyl)-phenol is white crystal or colorless to pale yellow liquid which is Insoluble in water, easily soluble in acetone, and soluble in ethanol. When heated to decomposition it emits toxic vapors of SOx. The other characteristics of 2-Methyl-4,6-bis((octylthio)methyl)-phenol can be summarized as: (1)ACD/LogP: 10.07; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 10.07; (4)ACD/LogD (pH 7.4): 10.07; (5)#H bond acceptors: 1; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 19; (8)Index of Refraction: 1.532; (9)Molar Refractivity: 132.91 cm3; (10)Molar Volume: 428.8 cm3; (11)Polarizability: 52.69×10-24 cm3; (12)Surface Tension: 38.9 dyne/cm; (13)Enthalpy of Vaporization: 83.83 kJ/mol; (14)Vapour Pressure: 6.06E-12 mmHg at 25°C; (15)Rotatable Bond Count: 18; (16)Tautomer Count: 3; (17)Exact Mass: 424.283357; (18)MonoIsotopic Mass: 424.283357; (19)Topological Polar Surface Area: 70.8; (20)Heavy Atom Count: 28; (21)Complexity: 337. Uses of 2-Methyl-4,6-bis((octylthio)methyl)-phenol: It is environmentally friendly antioxidant which is mainly used in the synthetic rubber such as butadiene rubber, styrene butadiene rubber, ethylene propylene rubber, nitrile rubber, thermoplastic elastomers and high molecular polymer such as lubricants, sealants and plastics. When you are using this chemical, please be cautious about it as the following: People can use the following data to convert to the molecule structure. |
| Safety Data | |
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