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CAS No.: | 61260-10-4 |
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Name: | 4-[1-(4-HYDROXY-3,5-DIMETHYLPHENYL)-1-METHYLPROPYL]-2,6-DIMETHYLPHENOL |
Molecular Structure: | |
Formula: | C20H26O2 |
Molecular Weight: | 298.425 |
Synonyms: | 2,2-Bis(4-hydroxy-3,5-dimethylphenyl)butane;4-[1-(4-Hydroxy-3, 5-dimethylphenyl)-1-methylpropyl]-2, 6-dimethylphenol; |
Density: | 1.061 g/cm3 |
Melting Point: | 170 °C |
Boiling Point: | 433.6 °C at 760 mmHg |
Flash Point: | 194.1 °C |
PSA: | 40.46000 |
LogP: | 5.04740 |
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The Phenol, 4, 4'-(1-methylpropylidene)bis[2, 6-dimethyl-, with the CAS registry number 61260-10-4, is also known as 4-[1-(4-Hydroxy-3, 5-dimethylphenyl)-1-methylpropyl]-2, 6-dimethylphenol. This chemical's molecular formula is C20H26O2 and molecular weight is 298.42. What's more, its systematic name is 4, 4'-Butane-2, 2-diylbis(2, 6-dimethylphenol).
Physical properties about Phenol, 4, 4'-(1-methylpropylidene)bis[2, 6-dimethyl- are: (1)ACD/LogP: 5.80; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 18.46 Å2; (7)Index of Refraction: 1.568; (8)Molar Refractivity: 92.1 cm3; (9)Molar Volume: 281.1 cm3; (10)Polarizability: 36.51×10-24 cm3; (11)Surface Tension: 40.6 dyne/cm; (12)Density: 1.061 g/cm3; (13)Flash Point: 194.1 °C; (14)Enthalpy of Vaporization: 71.62 kJ/mol; (15)Boiling Point: 433.6 °C at 760 mmHg; (16)Vapour Pressure: 3.99E-08 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Oc1c(cc(cc1C)C(c2cc(c(O)c(c2)C)C)(C)CC)C
(2) InChI: InChI=1/C20H26O2/c1-7-20(6,16-8-12(2)18(21)13(3)9-16)17-10-14(4)19(22)15(5)11-17/h8-11,21-22H,7H2,1-6H3
(3) InChIKey: CDQGZJGHIVUWQA-UHFFFAOYAM