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CAS No.: | 1844-00-4 |
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Name: | 4,4'-(2-METHYLPROPYLIDENE)DIPHENOL |
Article Data: | 14 |
Molecular Structure: | |
Formula: | C16H18O2 |
Molecular Weight: | 242.318 |
Synonyms: | Phenol,4,4'-isobutylidenedi- (6CI,7CI,8CI);1,1-Bis(4-hydroxyphenyl)-2-methylpropane;1,1-Bis(4'-hydroxyphenyl)-2-methylpropane;4,4'-(2-Methylpropylidene)bisphenol;4,4'-Isobutylidenebisphenol;NSC 17960; |
Density: | 1.12 g/cm3 |
Melting Point: | 153~158℃ |
Boiling Point: | 393.6 °C at 760 mmHg |
Flash Point: | 185 °C |
PSA: | 40.46000 |
LogP: | 3.88570 |
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The Phenol,4,4'-(2-methylpropylidene)bis-, with the CAS registry number 1844-00-4, is also known as 4,4'-Isobutylidenediphenol. This chemical's molecular formula is C16H18O2 and molecular weight is 242.3129. Its systematic name is called 4,4'-(2-methylpropane-1,1-diyl)diphenol.
Physical properties of Phenol,4,4'-(2-methylpropylidene)bis-: (1)ACD/LogP: 3.96; (2)#H bond acceptors: 2; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 5; (5)Index of Refraction: 1.591; (6)Molar Refractivity: 73.19 cm3; (7)Molar Volume: 216.3 cm3; (8)Surface Tension: 46.1 dyne/cm; (9)Density: 1.12 g/cm3; (10)Flash Point: 185 °C; (11)Enthalpy of Vaporization: 66.86 kJ/mol; (12)Boiling Point: 393.6 °C at 760 mmHg; (13)Vapour Pressure: 9.28E-07 mmHg at 25°C.
Preparation: this chemical can be prepared by isobutyraldehyde and phenol.
Uses of Phenol,4,4'-(2-methylpropylidene)bis-: it can be used to produce 4-(2-Methyl-propenyl)-phenol by heating. This reaction will need reagent KOH. The yield is about 50%.
You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccc(cc1)C(c2ccc(O)cc2)C(C)C
(2)InChI: InChI=1/C16H18O2/c1-11(2)16(12-3-7-14(17)8-4-12)13-5-9-15(18)10-6-13/h3-11,16-18H,1-2H3
(3)InChIKey: ZGZVGZCIFZBNCN-UHFFFAOYAO