Cyclohexa-1,4-diene
Synonym(s):1,4-Dihydrobenzene
- CAS NO.:628-41-1
- Empirical Formula: C6H8
- Molecular Weight: 80.13
- MDL number: MFCD00001535
- EINECS: 211-043-1
- SAFETY DATA SHEET (SDS)
- Update Date: 2023-12-26 11:30:52
What is Cyclohexa-1,4-diene?
Chemical properties
colourless liquid
The Uses of Cyclohexa-1,4-diene
Reagent for selectively cleaving benzyl esters in the presence of benzyl ethers by catalytic H-transfer.
The Uses of Cyclohexa-1,4-diene
Forms benzene at elevated temperatures in the presence of a ruthenium(II)-triphenylphosphine catalyst.1
The Uses of Cyclohexa-1,4-diene
1,4-Cyclohexadiene is used to study the formation of parent ion from heavy fragmentation on irradiation with a high-intensity laser pulse. It is also used as a very effective hydrogen donor for catalytic hydrogenation reaction. It forms benzene at elevated temperatures in the presence of a ruthenium(II)-triphenylphosphine catalyst.
What are the applications of Application
1,4-Cyclohexadiene is an effective hydrogen donor
Definition
ChEBI: Cyclohexa-1,4-diene is a cyclohexadiene.
General Description
1,4-Cyclohexadiene is an effective hydrogen donor for catalytic hydrogenation reactions. It can rapidly replace benzyl groups of N-benzyloxycarbamates, benzyl esters, benzyl ethers and benzyl amines with hydrogen. It forms benzene at elevated temperatures in the presence of a ruthenium(II)-triphenylphosphine catalyst.
Purification Methods
Dry the diene over CaCl2 and distil it in a vacuum under N2. [Hückel & W.rffel Chem Ber 88 338 1955, Giovannini & Wegmüller Helv Chim Acta 42 1142 1959.] [Beilstein 5 IV 385.]
Properties of Cyclohexa-1,4-diene
Melting point: | -49.2 °C |
Boiling point: | 88-89 °C (lit.) |
Density | 0.847 g/mL at 25 °C (lit.) |
refractive index | n |
Flash point: | 20 °F |
storage temp. | 2-8°C |
form | Liquid |
color | Clear colorless |
Water Solubility | Miscible with organic solvents like diethyl ether, tetrahydrofuran and toluene.Immiscible with water. |
BRN | 1900733 |
Exposure limits | ACGIH: TWA 2 mg/m3 NIOSH: TWA 10 mg/m3 |
Dielectric constant | 2.2599999999999998 |
Stability: | Stable. Highly flammable. Incompatible with strong oxidizing agents. |
CAS DataBase Reference | 628-41-1(CAS DataBase Reference) |
NIST Chemistry Reference | 1,4-Cyclohexadiene(628-41-1) |
EPA Substance Registry System | 1,4-Cyclohexadiene (628-41-1) |
Safety information for Cyclohexa-1,4-diene
Signal word | Danger |
Pictogram(s) |
Flame Flammables GHS02 Health Hazard GHS08 |
GHS Hazard Statements |
H225:Flammable liquids H340:Germ cell mutagenicity H350:Carcinogenicity H373:Specific target organ toxicity, repeated exposure |
Precautionary Statement Codes |
P202:Do not handle until all safety precautions have been read and understood. P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P233:Keep container tightly closed. P240:Ground/bond container and receiving equipment. P241:Use explosion-proof electrical/ventilating/lighting/…/equipment. P308+P313:IF exposed or concerned: Get medical advice/attention. |
Computed Descriptors for Cyclohexa-1,4-diene
InChIKey | UVJHQYIOXKWHFD-UHFFFAOYSA-N |
Abamectin manufacturer
JSK Chemicals
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