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| Name |
Hexafluorodichlorobutene |
EINECS | N/A |
| CAS No. | 11111-49-2 | Density | 1.625g/cm3 |
| PSA | 0.00000 | LogP | 0.00000 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C4 H2 Cl2 F6 | Boiling Point | 68.5°Cat760mmHg |
| Molecular Weight | 0 | Flash Point | 3.2°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | A poison by inhalation. When heated to decomposition it emits very toxic fumes of Cl− and F−. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Hexafluorodichlorobutene |
Hexafluorodichlorobutene Chemical Properties
Product Name: Hexafluorodichlorobutene (CAS NO.11111-49-2)
Molecular Formula: C4Cl2F6
Molecular Weight: 232.9392g/mol
Mol File: 11111-49-2.mol
Boiling point: 77 °C at 760 mmHg
Flash Point: 5.5 °C
Density: 1.625 g/cm3
Surface Tension: 17.9 dyne/cm
Enthalpy of Vaporization: 30.48 kJ/mol
Vapour Pressure: 109 mmHg at 25°C
XLogP3-AA: 3.5
H-Bond Donor: 0
H-Bond Acceptor: 6
Structure Descriptors of Hexafluorodichlorobutene (CAS NO.11111-49-2):
IUPAC Name: (E)-2,3-dichloro-1,1,1,4,4,4-hexafluorobut-2-ene
Canonical SMILES: C(=C(C(F)(F)F)Cl)(C(F)(F)F)Cl
Isomeric SMILES: C(=C(/C(F)(F)F)\Cl)(\C(F)(F)F)/Cl
InChI: InChI=1S/C4Cl2F6/c5-1(3(7,8)9)2(6)4(10,11)12/b2-1+
InChIKey: XDIDQEGAKCWQQP-OWOJBTEDSA-N
Hexafluorodichlorobutene Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| dog | LC50 | inhalation | 182ppm/4H (182ppm) | LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES | Fluoride Abstracts. Vol. 5, Pg. 4, 1972. |
| monkey | LC50 | inhalation | 54ppm/3H (54ppm) | LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES | Fluoride Abstracts. Vol. 5, Pg. 4, 1972. |
| mouse | LC50 | inhalation | 26ppm/4H (26ppm) | LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES | Fluoride Abstracts. Vol. 5, Pg. 4, 1972. |
| rabbit | LCLo | inhalation | 500ppm/1H (500ppm) | LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA | Fluoride Abstracts. Vol. 5, Pg. 4, 1972. |
| rat | LC50 | inhalation | 16ppm/4H (16ppm) | LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES | Fluoride Abstracts. Vol. 5, Pg. 4, 1972. |
Hexafluorodichlorobutene Safety Profile
A poison by inhalation. When heated to decomposition it emits very toxic fumes of Cl− and F−.
Hexafluorodichlorobutene Specification
Hexafluorodichlorobutene , its CAS NO. is 11111-49-2, the synonyms are HFCB ; Butene, dichlorohexafluoro- .
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