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1,1,2,2-Tetrakis(4-hydroxyphenyl)ethane

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Name

1,1,2,2-Tetrakis(4-hydroxyphenyl)ethane

EINECS 231-782-3
CAS No. 7727-33-5 Density 1.309 g/cm3
PSA 80.92000 LogP 5.47300
Solubility N/A Melting Point >250°C (dec.)
Formula C26H22O4 Boiling Point 566.4 °C at 760 mmHg
Molecular Weight 398.458 Flash Point 252.9 °C
Transport Information N/A Appearance off-white powder/Brown crystal
Safety 36/37 Risk Codes 40
Molecular Structure Molecular Structure of 7727-33-5 (1,1,2,2-Tetrakis(4-hydroxyphenyl)ethane) Hazard Symbols HarmfulXn
Synonyms

Phenol,4,4',4'',4'''-ethanediylidenetetra- (6CI);1,1,2,2-Tetrakis(4-hydroxyphenyl)ethane;1,1,2,2-Tetrakis(p-hydroxyphenyl)ethane;NSC 310098;TEP;TEP-DF;Tekp-E;

 

1,1,2,2-Tetrakis(4-hydroxyphenyl)ethane Specification

The 1,1,2,2-Tetrakis(4-hydroxyphenyl)ethane, with the cas registry number 7727-33-5, has the systematic name of 4,4',4'',4'''-ethane-1,1,2,2-tetrayltetraphenol. Its produt belongs to the category of Aromatics Compounds and Aromatics. And the molecular formula of the chemical is C26H22O4.

The characteristics of this chemical are as followings: (1)ACD/LogP: 4.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.74; (4)ACD/LogD (pH 7.4): 4.73; (5)ACD/BCF (pH 5.5): 2342.45; (6)ACD/BCF (pH 7.4): 2317.79; (7)ACD/KOC (pH 5.5): 8986.48; (8)ACD/KOC (pH 7.4): 8891.88; (9)#H bond acceptors: 4; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 36.92 Å2; (13)Index of Refraction: 1.692; (14)Molar Refractivity: 116.61 cm3; (15)Molar Volume: 304.3 cm3; (16)Polarizability: 46.23×10-24cm3; (17)Surface Tension: 64.3 dyne/cm; (18)Density: 1.309 g/cm3; (19)Flash Point: 252.9 °C; (20)Enthalpy of Vaporization: 88.21 kJ/mol; (21)Boiling Point: 566.4 °C at 760 mmHg; (22)Vapour Pressure: 1.97E-13 mmHg at 25°C.

You should be cautious while dealing with this chemical. It may cause carcinogenic effect. Therefore, you had better wear suitable protective clothing and gloves when you contact with it.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Oc1ccc(cc1)C(c2ccc(O)cc2)C(c3ccc(O)cc3)c4ccc(O)cc4
(2)InChI: InChI=1/C26H22O4/c27-21-9-1-17(2-10-21)25(18-3-11-22(28)12-4-18)26(19-5-13-23(29)14-6-19)20-7-15-24(30)16-8-20/h1-16,25-30H
(3)InChIKey: HDPBBNNDDQOWPJ-UHFFFAOYAY

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