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Phenol,4-(1-methylethyl)-, carbonate (2:1) (9CI)

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Phenol,4-(1-methylethyl)-, carbonate (2:1) (9CI)

CAS No. 2167-55-7 Density 1.069 g/cm3
PSA 35.53000 LogP 5.51120
Solubility N/A Melting Point N/A
Formula C19H22O3 Boiling Point 380.2 °C at 760 mmHg
Molecular Weight 298.382 Flash Point 120.5 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 2167-55-7 (bis(4-propan-2-ylphenyl) carbonate) Hazard Symbols N/A

Carbonicacid, di-p-cumenyl ester (6CI,7CI,8CI);Di-p-cumenyl carbonate;NSC 47192;Bis[4-(propan-2-yl)phenyl] carbonate;


Phenol,4-(1-methylethyl)-, carbonate (2:1) (9CI) Specification

The Phenol,4-(1-methylethyl)-, carbonate (2:1) (9CI), with the CAS registry number 2167-55-7, is also known as Di-p-cumenyl carbonate. This chemical's molecular formula is C19H22O3 and molecular weight is 298.38. What's more, its systematic name is Bis[4-(propan-2-yl)phenyl] carbonate.

Physical properties of Phenol,4-(1-methylethyl)-, carbonate (2:1) (9CI) are: (1)ACD/LogP: 5.96; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 35.53 Å2; (7)Index of Refraction: 1.54; (8)Molar Refractivity: 87.58 cm3; (9)Molar Volume: 279 cm3; (10)Polarizability: 34.71×10-24 cm3; (11)Surface Tension: 37.5 dyne/cm; (12)Density: 1.069 g/cm3; (13)Flash Point: 120.5 °C; (14)Enthalpy of Vaporization: 62.83 kJ/mol; (15)Boiling Point: 380.2 °C at 760 mmHg; (16)Vapour Pressure: 5.54E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Oc1ccc(cc1)C(C)C)Oc2ccc(cc2)C(C)C
(2)InChI: InChI=1/C19H22O3/c1-13(2)15-5-9-17(10-6-15)21-19(20)22-18-11-7-16(8-12-18)14(3)4/h5-14H,1-4H3

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