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423-38-1

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Basic Information
CAS No.: 423-38-1
Name: HEXAFLUORO-1,1,3,4-TETRACHLOROBUTANE
Article Data: 3
Molecular Structure:
Molecular Structure of 423-38-1 (HEXAFLUORO-1,1,3,4-TETRACHLOROBUTANE)
Formula: C4Cl4F6
Molecular Weight: 303.846
Synonyms: Butane,1,1,3,4-tetrachlorohexafluoro- (6CI,7CI,8CI);1,2,4,4-Tetrachloro-1,1,2,3,3,4-hexafluorobutane;Hexafluoro-1,1,3,4-tetrachlorobutane;1,1,3,4-tetrachloro-1,2,2,3,4,4-hexafluorobutane;
Density: 1.756 g/cm3
Boiling Point: 133.7 °C at 760 mmHg
Flash Point: 49.1 °C
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 23-26-36
PSA: 0.00000
LogP: 4.45880
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Specification

The Butane,1,1,3,4-tetrachloro-1,2,2,3,4,4-hexafluoro-, with the CAS registry number 423-38-1, is also known as Hexafluoro-1,1,3,4-tetrachlorobutane, tech. This chemical's molecular formula is C4Cl4F6 and molecular weight is 303.85. What's more, both its IUPAC name and systematic name are the same which is called 1,1,3,4-Tetrachloro-1,2,2,3,4,4-hexafluorobutane.

Physical properties about Butane,1,1,3,4-tetrachloro-1,2,2,3,4,4-hexafluoro- are: (1)ACD/LogP: 6.10; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.1; (4)ACD/LogD (pH 7.4): 6.1; (5)ACD/BCF (pH 5.5): 25496.85; (6)ACD/BCF (pH 7.4): 25496.85; (7)ACD/KOC (pH 5.5): 49630.46; (8)ACD/KOC (pH 7.4): 49630.46; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.388; (14)Molar Refractivity: 40.82 cm3; (15)Molar Volume: 172.9 cm3; (16)Surface Tension: 23.9 dyne/cm; (17)Density: 1.756 g/cm3; (18)Flash Point: 49.1 °C; (19)Enthalpy of Vaporization: 35.59 kJ/mol; (20)Boiling Point: 133.7 °C at 760 mmHg; (21)Vapour Pressure: 10.3 mmHg at 25 °C.

Uses of Butane,1,1,3,4-tetrachloro-1,2,2,3,4,4-hexafluoro-: it is used to produce other chemicals. For example, it is used to produce 3,4-Dichloro-pentafluoro-butyric acid. This reaction needs reagent (NH4)2S2O8/HCO2Na·2H2O and solvent Dimethylformamide at temperature of 30 °C. The reaction time is 5 hours. The yield is 78.6 %.

When you are dealing with this chemical, you should be very careful. This chemical is irritating to eyes, respiratory system and skin. Therefore, you should wear suitable protective clothing. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice. You can not breathe the gas/fumes/vapour/spray.

You can still convert the following datas into molecular structure:
(1) SMILES: FC(Cl)(C(F)(F)C(Cl)(Cl)F)C(Cl)(F)F
(2) InChI: InChI=1/C4Cl4F6/c5-1(9,4(8,13)14)2(10,11)3(6,7)12
(3) InChIKey: CMVFABYKWZDQMC-UHFFFAOYAG