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1,6-Diiodododecafluorohexane

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Name

1,6-Diiodododecafluorohexane

EINECS 206-794-7
CAS No. 375-80-4 Density 2.398g/cm3
PSA 0.00000 LogP 5.58320
Solubility N/A Melting Point 25-30 °C(lit.)
Formula C6F12I2 Boiling Point 185.4 °C at 760 mmHg
Molecular Weight 553.856 Flash Point 77.9 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 20/21/22-36/37/38
Molecular Structure Molecular Structure of 375-80-4 (1,6-Diiodododecafluorohexane) Hazard Symbols ToxicTIrritantXi
Synonyms

Hexane,dodecafluoro-1,6-diiodo- (7CI,8CI);1,1,2,2,3,3,4,4,5,5,6,6-Dodecafluoro-1,6-diiodohexane;1,6-Diiodododecafluorohexane;1,6-Diiodoperfluorohexane;Dodecafluoro-1,6-diiodohexane;a,w-Diiodoperfluorohexane;

Article Data 14

1,6-Diiodododecafluorohexane Specification

The 1,6-Diiodododecafluorohexane with the cas number 375-80-4 is also called Hexane,1,1,2,2,3,3,4,4,5,5,6,6-dodecafluoro-1,6-diiodo-. Both the systematic name and IUPAC name are 1,1,2,2,3,3,4,4,5,5,6,6-dodecafluoro-1,6-diiodohexane. Its EINECS registry number is 206-794-7. The molecular formula is C6F12I2. This chemical belongs to the following product categories: (1)Fluorous Chemistry; (2)Fluorous Compounds; (3)Synthetic Organic Chemistry.

The properties of the chemical are: (1)ACD/LogP: 8.78; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 8.78; (4)ACD/LogD (pH 7.4): 8.78; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 1428008.5; (8)ACD/KOC (pH 7.4): 1428008.5; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.412; (14)Molar Refractivity: 57.54 cm3; (15)Molar Volume: 230.8 cm3; (16)Polarizability: 22.81×10-24cm3; (17)Surface Tension: 22.6 dyne/cm; (18)Enthalpy of Vaporization: 40.44 kJ/mol; (19)Vapour Pressure: 0.956 mmHg at 25°C.

While using this chemical, you should be very cautious. This chemical is harmful by inhalation, in contact with skin and if swallowed. It is not only irritating to skin, but also irritating to eyes and respiratory system. Therefore, you should take the following instructions. Firstly, you should wear suitable protective clothing, gloves and eye/face protection. Then in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(C(F)(F)C(F)(F)I)C(F)(F)C(F)(F)C(F)(F)I
(2)InChI: InChI=1/C6F12I2/c7-1(8,3(11,12)5(15,16)19)2(9,10)4(13,14)6(17,18)20
(3)InChIKey: JOQDDLBOAIKFQX-UHFFFAOYAG

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