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CAS No.: | 10224-18-7 |
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Name: | 2,2-BIS(4-ISOCYANATOPHENYL)HEXAFLUOROPROPANE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C17H8F6N2O2 |
Molecular Weight: | 386.253 |
Synonyms: | Isocyanicacid, [2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]di-p-phenylene ester(7CI,8CI);2,2'-Bis(p-isocyanatophenyl)hexafluoropropane;(Hexafluoroisopropylidene)di-p-phenylene diisocyanate;Bisisocyanotophenylhexafluoropropane; |
Density: | 1.34 g/cm3 |
Boiling Point: | 340.8 °C at 760 mmHg |
Flash Point: | 189.1 °C |
Hazard Symbols: | Xi |
PSA: | 58.86000 |
LogP: | 5.03190 |
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The Enzene, 1, 1'-[2, 2, 2-trifluoro-1-(trifluoromethyl)ethylidene]bis[4-isocyanato- (9CI), with the CAS registry number 10224-18-7, is also known as Bisisocyanotophenylhexafluoropropane. It belongs to the product categories of Bisphenol AF type Compounds (for High-Performance Polymer Research); Functional Materials; Reagent for High-Performance Polymer Research. This chemical's molecular formula is C17H8F6N2O2 and molecular weight is 386.25. What's more, its systematic name is 1, 1'-(1, 1, 1, 3, 3, 3-Hexafluoropropane-2, 2-diyl)bis(4-isocyanatobenzene). In addition, it must be stored in airtight containers and placed in a dry, ventilated place. Besides, this chemical may cause inflammation to the skin or other mucous membranes.
Physical properties about Enzene, 1, 1'-[2, 2, 2-trifluoro-1-(trifluoromethyl)ethylidene]bis[4-isocyanato- (9CI) are: (1)ACD/LogP: 5.02; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.02; (4)ACD/LogD (pH 7.4): 5.02; (5)ACD/BCF (pH 5.5): 3838.89; (6)ACD/BCF (pH 7.4): 3838.89; (7)ACD/KOC (pH 5.5): 12798.78; (8)ACD/KOC (pH 7.4): 12798.78; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 58.86 Å2; (13)Index of Refraction: 1.5; (14)Molar Refractivity: 84.42 cm3; (15)Molar Volume: 286.6 cm3; (16)Polarizability: 33.47×10-24 cm3; (17)Surface Tension: 35 dyne/cm; (18)Density: 1.34 g/cm3; (19)Flash Point: 189.1 °C; (20)Enthalpy of Vaporization: 58.44 kJ/mol; (21)Boiling Point: 340.8 °C at 760 mmHg; (22)Vapour Pressure: 8.41E-05 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: FC(F)(F)C(c1ccc(\N=C=O)cc1)(c2ccc(\N=C=O)cc2)C(F)(F)F
(2) InChI: InChI=1/C17H8F6N2O2/c18-16(19,20)15(17(21,22)23,11-1-5-13(6-2-11)24-9-26)12-3-7-14(8-4-12)25-10-27/h1-8H
(3) InChIKey: QIPLQPPNURSGKC-UHFFFAOYAR