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379215-40-4

Basic Information
CAS No.: 379215-40-4
Name: PERFLUORODECANONITRILE
Molecular Structure:
Molecular Structure of 379215-40-4 (PERFLUORODECANONITRILE)
Formula: C10F19N
Molecular Weight: 495.086
Synonyms: Decanenitrile,nonadecafluoro- (9CI);Perfluorodecanonitrile;Perfluorodecanonitrile 97%;Nonadecafluorodecanenitrile;2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-nonadecafluorodecanenitrile;
Density: 1.701 g/cm3
Boiling Point: 160.6 °C at 760 mmHg
Flash Point: 50.9 °C
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36/37/39
PSA: 23.79000
LogP: 6.15468
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Specification

The Decanenitrile,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-nonadecafluoro-, with the CAS registry number 379215-40-4, is also known as Perfluorodecanonitrile. This chemical's molecular formula is C10F19N and molecular weight is 495.08. What's more, its systematic name is nonadecafluorodecanenitrile.

Physical properties of Decanenitrile,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-nonadecafluoro- are: (1)ACD/LogP: 9.37; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 9.37; (4)ACD/LogD (pH 7.4): 9.37; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 2962577.25; (8)ACD/KOC (pH 7.4): 2962577.25; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 23.79 Å2; (13)Index of Refraction: 1.28; (14)Molar Refractivity: 51.09 cm3; (15)Molar Volume: 290.9 cm3; (16)Polarizability: 20.25×10-24 cm3; (17)Surface Tension: 15.2 dyne/cm; (18)Density: 1.701 g/cm3; (19)Flash Point: 50.9 °C; (20)Enthalpy of Vaporization: 39.72 kJ/mol; (21)Boiling Point: 160.6 °C at 760 mmHg; (22)Vapour Pressure: 2.37 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: FC(F)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C#N
(2)InChI: InChI=1/C10F19N/c11-2(12,1-30)3(13,14)4(15,16)5(17,18)6(19,20)7(21,22)8(23,24)9(25,26)10(27,28)29
(3)InChIKey: QXBUHLMUCFBZOL-UHFFFAOYAT