2-(5-hexenyl)thiirane
1,7-Octadiene
Conditions | Yield |
---|---|
With hydrogen sulfide; triphenylphosphine; methyltrioxorhenium(VII) In [D3]acetonitrile for 1h; Ambient temperature; | 100% |
With tri-n-butyl-tin hydride; 2,2'-azobis(isobutyronitrile) In benzene Heating; | 85% |
Conditions | Yield |
---|---|
With triethanolamine; (4,4'-di-tert-butyl-2,2'-dipyridyl)-bis-(2-phenylpyridine(-1H))-iridium(III) hexafluorophosphate; [Ni(2,2′:6′,2''-terpyridine)(pyridine)(CH3CN)2](PF6)2 In acetonitrile at 23 - 28℃; for 12h; Inert atmosphere; Sealed tube; Irradiation; | 98% |
With diethyl ether; sodium |
Conditions | Yield |
---|---|
With formic acid; triethylamine; tris(dibenzylideneacetone)dipalladium(0) chloroform complex; tributylphosphine In tetrahydrofuran for 4h; Heating; | 76% |
(E)-1-acetoxy-2,7-octadiene
1,7-Octadiene
Conditions | Yield |
---|---|
With formic acid; triethylamine; tris(dibenzylideneacetone)dipalladium(0) chloroform complex; tributylphosphine In tetrahydrofuran for 2h; Heating; | 67% |
With ammonium formate; tris(dibenzylideneacetone)dipalladium chloroform complex; tributylphosphine In 1,4-dioxane for 2h; Heating; | 100 % Chromat. |
7,8-diazabicyclo<4.2.2>dec-7-ene
A
(Z)-Cyclooctene
B
cis-bicyclo<4.2.0>octane
C
1,7-Octadiene
Conditions | Yield |
---|---|
With 4-tert-Butylcatechol In Petroleum ether at 160 - 170℃; for 69h; | A 14% B 23% C 30% |
In Petroleum ether at 160 - 170℃; for 69h; Mechanism; 4-t-butylpyrocatechol; | A 14% B 23% C 30% |
In Petroleum ether at 170℃; | |
In Petroleum ether at 170℃; also with deuterio labelled substrate; |
Conditions | Yield |
---|---|
With lanthanum; iodine In tetrahydrofuran at 67℃; for 2h; | 26% |
With α-picoline; manganese; trifluoroacetic acid; cobalt(II) bromide In acetonitrile at 50℃; | |
With triethanolamine; (4,4'-di-tert-butyl-2,2'-dipyridyl)-bis-(2-phenylpyridine(-1H))-iridium(III) hexafluorophosphate; [Ni(2,2′:6′,2''-terpyridine)(pyridine)(CH3CN)2](PF6)2 for 12h; Irradiation; Inert atmosphere; |
Conditions | Yield |
---|---|
In tetrahydrofuran-d8 at 22℃; Inert atmosphere; Schlenk technique; | A 22% B 22% |
Conditions | Yield |
---|---|
In hexane at 16 - 18℃; under 53203.6 Torr; Pressure; Temperature; | 20.1% |
at 25 - 80℃; under 30003 - 150015 Torr; for 24 - 42h; Product distribution / selectivity; |
Conditions | Yield |
---|---|
palladium anchored polystyrene In neat (no solvent) at 25℃; under 1551.4 Torr; for 36h; | A 20% B 20% |
palladium anchored polystyrene In neat (no solvent) at 25℃; under 1551.4 Torr; for 36h; | A 20% B 20% |
Conditions | Yield |
---|---|
Stage #1: buta-1,3-diene With TEMPOL; sodium methylate; palladium diacetate In 1-methyl-pyrrolidin-2-one at -5 - 75℃; under 7500.75 Torr; Inert atmosphere; Stage #2: With formic acid In 1-methyl-pyrrolidin-2-one at 80 - 90℃; under 15001.5 Torr; Product distribution / selectivity; Inert atmosphere; | A 5.5% B 94.3 %Chromat. |
With formic acid; triethylamine; palladium diacetate; triphenylphosphine In DMF (N,N-dimethyl-formamide) at 90℃; under 750.075 Torr; for 1.5h; Product distribution / selectivity; |
Conditions | Yield |
---|---|
With ammonium sulfate; ammonia; sodium Reagens 4: Aether; | |
With ethylene dibromide; copper(I) bromide; lithium bromide; zinc In tetrahydrofuran; ethanol Heating; |
Conditions | Yield |
---|---|
at 500℃; Pyrolysis; |
Conditions | Yield |
---|---|
With diethyl ether |
Conditions | Yield |
---|---|
With diethyl ether |
(Z)-Cyclooctene
1,7-Octadiene
Conditions | Yield |
---|---|
at 550℃; | |
at 633℃; Thermodynamic data; Rate constant; further temp.; energy of activation; |
Conditions | Yield |
---|---|
at 500℃; |
Conditions | Yield |
---|---|
With acetic anhydride; bis-triphenylphosphine-palladium(II) chloride at 250℃; under 735.5 Torr; Yield given; | |
Stage #1: 1,10-decanedioic acid With bis(1,5-cyclooctadiene)diiridium(I) dichloride; triphenylphosphine; potassium iodide at 20℃; for 0.5h; Inert atmosphere; Schlenk technique; Stage #2: With acetic anhydride at 160℃; for 5h; Inert atmosphere; Schlenk technique; regioselective reaction; | |
With formate dehydrogenase; 1200 U catalase; OleT in combination with the putidaredoxin electron-transfer system CamAB; P450 monooxygenase OleT; ammonium formate; β-nicotinamide adenine dinucleotide, disodium salt, reduced form In ethanol at 4℃; for 72h; Catalytic behavior; Enzymatic reaction; | |
Multi-step reaction with 2 steps 1: P450 monooxygenase OleT; OleT in combination with the putidaredoxin electron-transfer system CamAB; formate dehydrogenase; β-nicotinamide adenine dinucleotide, disodium salt, reduced form; 1200 U catalase; ammonium formate / ethanol / Enzymatic reaction 2: P450 monooxygenase OleT; OleT in combination with the putidaredoxin electron-transfer system CamAB; formate dehydrogenase; β-nicotinamide adenine dinucleotide, disodium salt, reduced form; 1200 U catalase; ammonium formate / ethanol / Enzymatic reaction View Scheme |
bicyclo<4.2.0>octane
A
ethene
B
1,7-Octadiene
C
cyclohexene
Conditions | Yield |
---|---|
In pentane Quantum yield; Irradiation; |
Conditions | Yield |
---|---|
With ammonium formate; tris(dibenzylideneacetone)dipalladium chloroform complex; tributylphosphine In 1,4-dioxane for 2h; Heating; | A 2 % Chromat. B 98 % Chromat. |
Conditions | Yield |
---|---|
With ammonium formate; tris(dibenzylideneacetone)dipalladium chloroform complex; tributylphosphine In 1,4-dioxane for 2h; Heating; | A 1 % Chromat. B 99 % Chromat. |
Conditions | Yield |
---|---|
at 633℃; Rate constant; further temperature; |
Conditions | Yield |
---|---|
at 300.1℃; Rate constant; Thermodynamic data; further temperatures; energy of activation; ΔH(exit.); ΔS(exit.); |
(E)-cyclooctene
A
(Z)-Cyclooctene
B
vinylcyclohexane
C
1,7-Octadiene
Conditions | Yield |
---|---|
at 512℃; Rate constant; further temperatures; |
Conditions | Yield |
---|---|
With ammonium formate; tris(dibenzylideneacetone)dipalladium chloroform complex; tributylphosphine In 1,4-dioxane for 2h; Heating; | A 4 % Chromat. B 96 % Chromat. |
Conditions | Yield |
---|---|
With ammonium formate; tris(dibenzylideneacetone)dipalladium chloroform complex; tributylphosphine In 1,4-dioxane for 2h; Heating; | A 30 % Chromat. B 70 % Chromat. |
With ammonium formate; bis-triphenylphosphine-palladium(II) chloride; triphenylphosphine In 1,4-dioxane at 100℃; for 2h; Product distribution; other catalysts, other ligands; | A 21 % Chromat. B 79 % Chromat. |
With ammonium formate; tris(dibenzylideneacetone)dipalladium(0) chloroform complex; triethyl phosphite In 1,4-dioxane for 2h; Product distribution; Heating; var. catalyst,; | A 26 % Chromat. B 74 % Chromat. |
Conditions | Yield |
---|---|
With ammonium formate; tris(dibenzylideneacetone)dipalladium chloroform complex; tributylphosphine In 1,4-dioxane for 2h; Heating; | A 1 % Chromat. B 99 % Chromat. |
7,8-diazabicyclo<4.2.2>dec-7-ene
A
(Z)-Cyclooctene
B
cis-bicyclo<4.2.0>octane
C
1,7-Octadiene
Conditions | Yield |
---|---|
In cyclohexane at 170℃; Product distribution; Mechanism; var. temps; also direct and sensitised photolysis; | A 18 % Chromat. B 35 % Chromat. C 47 % Chromat. |
(E)-8-chloro-octa-1,6-diene
1,7-Octadiene
Conditions | Yield |
---|---|
With sodium formate; tris(dibenzylideneacetone)dipalladium chloroform complex; tributylphosphine In 1,4-dioxane for 2h; Heating; | 100 % Chromat. |
cis-8-thiabicyclo<4.3.0>nonane 8,8-dioxide
A
buta-1,3-diene
B
1,7-Octadiene
C
benzene
Conditions | Yield |
---|---|
at 850℃; under 0.005 Torr; Product distribution; other temperature (925 deg C); flash vacuum pyrolysis of bi- and tricyclic sulfones; | A n/a B 41 % Spectr. C 2 % Spectr. |
Conditions | Yield |
---|---|
at 336.9 - 817.9℃; Kinetics; Thermodynamic data; activation energy; |
Conditions | Yield |
---|---|
With hydrogen; sodium triethylborohydride In tetrahydrofuran at 23℃; under 30402 Torr; for 24h; Catalytic behavior; Inert atmosphere; Schlenk technique; | 100% |
With [Re(NO)(η(2)-H2)Br2(PiPr3)2]; dimethylamine borane; hydrogen at 90℃; under 7500.75 Torr; for 0.2h; Autoclave; | 88% |
With hydrogen; sodium triethylborohydride In tetrahydrofuran at 23℃; under 30003 Torr; for 48h; Reagent/catalyst; Autoclave; | 82% |
Conditions | Yield |
---|---|
With diazomethyl-trimethyl-silane; ruthenium Schiff-base In toluene at 70℃; for 1h; ring-closing metathesis; | 100% |
With diazomethyl-trimethyl-silane; ruthenium In toluene at 85℃; for 17h; Product distribution; Further Variations:; Catalysts; | 100% |
[2-((2,6-iPr2-Ph-imino)methyl)phenol][p-cymene][=CHPh]Ru2Cl3 In various solvent(s) at 70℃; for 4h; Product distribution; Further Variations:; Catalysts; Temperatures; | 100% |
Conditions | Yield |
---|---|
With palladium diacetate; triethylamine; triphenylphosphine In N,N-dimethyl-formamide at 150℃; for 24h; Heck Reaction; | 100% |
With palladium diacetate; triethylamine; triphenylphosphine In N,N-dimethyl-formamide at 150℃; for 24h; Heck Reaction; | 100% |
Conditions | Yield |
---|---|
With [2-(i-PrO)-C6H4]C(H)=RuCH[(Mes)NCH2CH2N(Mes)]Cl2 In toluene at 90℃; for 20h; Diels-Alder reaction; Sealed tube; Inert atmosphere; | 99% |
Conditions | Yield |
---|---|
With [2-(i-PrO)-C6H4]C(H)=RuCH[(Mes)NCH2CH2N(Mes)]Cl2 In toluene at 90℃; for 20h; Diels-Alder reaction; Sealed tube; Inert atmosphere; | 99% |
Conditions | Yield |
---|---|
With [2-(i-PrO)-C6H4]C(H)=RuCH[(Mes)NCH2CH2N(Mes)]Cl2 In toluene at 90℃; for 20h; Diels-Alder reaction; Sealed tube; Inert atmosphere; | 99% |
Conditions | Yield |
---|---|
With [2-(i-PrO)-C6H4]C(H)=RuCH[(Mes)NCH2CH2N(Mes)]Cl2 In toluene at 90℃; for 20h; Diels-Alder reaction; Sealed tube; Inert atmosphere; | 99% |
1,7-Octadiene
phenylacetylene
[1,4]naphthoquinone
2-phenyl-1,4,4a,9a-tetrahydroanthracene-9,10-dione
Conditions | Yield |
---|---|
With [2-(i-PrO)-C6H4]C(H)=RuCH[(Mes)NCH2CH2N(Mes)]Cl2 In toluene at 90℃; for 20h; Diels-Alder reaction; Sealed tube; Inert atmosphere; | 99% |
Conditions | Yield |
---|---|
With [2-(i-PrO)-C6H4]C(H)=RuCH[(Mes)NCH2CH2N(Mes)]Cl2 In toluene at 90℃; for 20h; Diels-Alder reaction; Sealed tube; Inert atmosphere; | 99% |
Conditions | Yield |
---|---|
With cobalt pivalate; 1-adamantyl isocyanide at 80℃; for 24h; Inert atmosphere; | 99% |
With cobalt pivalate; [1,3-bis(2,4,6-trimethylphenyl)imidazol]-2-ylidene at 80℃; for 24h; Inert atmosphere; | 60% |
2,4-bis[2,6-bis(2,4,6-trimethylphenyl)phenyl]-1,3-diphospha-2,4-diazacyclobutane
1,7-Octadiene
Conditions | Yield |
---|---|
In benzene at 20℃; for 1h; Inert atmosphere; | 99% |
Conditions | Yield |
---|---|
With diethylzinc In hexane; acetonitrile at -20℃; for 16h; Schlenk technique; Inert atmosphere; | 99% |
tetrafluoroboric acid diethyl ether
1,7-Octadiene
Conditions | Yield |
---|---|
In chlorobenzene under N2, addn. of HBF4*OEt2 to cooled soln. of Re-compd. at -45°C, then addn. of diene to the intermediate with stirring, stirring 15 h at 100°C; soln. filtered into hexane, filtration, washing (pentane), drying, mixt. of isomers; | 98% |
Conditions | Yield |
---|---|
With [2-(i-PrO)-C6H4]C(H)=RuCH[(Mes)NCH2CH2N(Mes)]Cl2 In toluene at 90℃; Sealed tube; Inert atmosphere; | 98% |
Conditions | Yield |
---|---|
With [2-(i-PrO)-C6H4]C(H)=RuCH[(Mes)NCH2CH2N(Mes)]Cl2 In toluene at 90℃; for 20h; Diels-Alder reaction; Sealed tube; Inert atmosphere; | 98% |
1-iodo-2,2,3,3,4,4,5,5,5-nonafluorobutane
1,7-Octadiene
1,1,1,2,2,3,3,4,4,13,13,14,14,15,15,16,16,16-octadecafluoro-6,11-diiodohexadecane
Conditions | Yield |
---|---|
With Sodium thiosulfate pentahydrate; 2,2'-azobis-(2,4-dimethylvaleronitrile) at 85℃; for 3h; | 97.5% |
(E)-1-phenyl-N-(1-phenylethylidene)methanamine
1,7-Octadiene
Conditions | Yield |
---|---|
Stage #1: (E)-1-phenyl-N-(1-phenylethylidene)methanamine; 1,7-Octadiene With molecular sieve; tris(triphenylphosphine)rhodium(I) chloride In toluene at 150℃; for 2h; Stage #2: With water Acid hydrolysis; Stage #3: With hydrogen; palladium on activated charcoal | 97% |
triphenylmethylacetonitrile oxide
1,7-Octadiene
5-(5-hexenyl)-3-(triphenylmethyl)-2-isoxazoline
Conditions | Yield |
---|---|
In benzene for 48h; Heating; | 96% |
Conditions | Yield |
---|---|
With 3-chloro-benzenecarboperoxoic acid In dichloromethane at 0℃; | 95% |
With 3-chloro-benzenecarboperoxoic acid at 10 - 23℃; for 16h; | 95.2% |
With 3-chloro-benzenecarboperoxoic acid In dichloromethane at 0 - 20℃; for 24h; | 94% |
Conditions | Yield |
---|---|
With manganese dioxide; dihydrogen peroxide In 1,4-dioxane; acetic acid | 95% |
With manganese dioxide; dihydrogen peroxide In 1,4-dioxane | 51% |
1,7-Octadiene
3,5-bis(trifluoromethyl)phenylacetylene
diethyl Fumarate
Conditions | Yield |
---|---|
With [2-(i-PrO)-C6H4]C(H)=RuCH[(Mes)NCH2CH2N(Mes)]Cl2 In toluene at 90℃; for 30h; Diels-Alder reaction; Sealed tube; Inert atmosphere; | 95% |
Conditions | Yield |
---|---|
With C29H31F3I2N2RuS In benzene-d6 at 80℃; for 1h; | 95% |
Conditions | Yield |
---|---|
[Y(C5Me4CH2SiMe2NCMe3)(THF)] In hexane at 20℃; for 48h; | 94% |
With ((HBPIMes,H)FeBr2); sodium triethylborohydride at 20℃; for 24h; Inert atmosphere; Schlenk technique; | 14% |
1,7-Octadiene
(E,E)-2,6-octadiene
Conditions | Yield |
---|---|
With C24H42N2PRu(1+)*F6P(1-) In [(2)H6]acetone at 20℃; for 0.166667h; stereoselective reaction; | 94% |
Conditions | Yield |
---|---|
With hydrogenchloride; oxygen; copper dichloride; palladium dichloride In tetrahydrofuran under 760 Torr; for 18h; Ambient temperature; | 93% |
Conditions | Yield |
---|---|
With platinum(0)-1,3-divinyl-1,1,3,3-tetramethyldisiloxane complex at 70 - 90℃; for 24h; | 93% |
With dihydrogen hexachloroplatinate; platinum(0)-1,3-divinyl-1,1,3,3-tetramethyldisiloxane complex In toluene at 70 - 90℃; for 24.1667h; | 93% |
perfluoroisopropyl iodide
1,7-Octadiene
9,10,10,10-Tetrafluoro-7-iodo-9-trifluoromethyldec-1-ene
Conditions | Yield |
---|---|
With bis(cyclopentadienyl)titanium dichloride; iron In ethanol at 55℃; for 10h; other per(poly)fluoroalkyl iodides and bromides; | 92% |
With bis(cyclopentadienyl)titanium dichloride; iron In ethanol at 55℃; for 10h; | 92% |
Conditions | Yield |
---|---|
With cobalt(II) bromide-[1,2-bis(diphenylphosphino)ethane]; zinc(II) iodide; zinc In dichloromethane for 20h; | 92% |
IUPAC Name: Octa-1,7-diene
The MF of 1,7-Octadiene (CAS NO.3710-30-3) is C8H14.
The MW of 1,7-Octadiene (CAS NO.3710-30-3) is 110.2.
Synonyms of 1,7-Octadiene (CAS NO.3710-30-3): Octa-1,7-diene ; .alpha.,.omega.-Octadiene
Product Categories: Acyclic;Alkenes;Organic Building Blocks
Apperance: clear colorless to slightly yellow liquid
Index of Refraction: 1.425
EINECS: 223-054-9
Density: 0.73 g/ml
Flash Point: 9.4 °C
Boiling Point: 115.5 °C
Melting Point: <-70 °C
Storage temp; Flammables area
BRN: 605288
1,7-Octadiene (CAS NO.3710-30-3) is used in organic synthesis.
1. | orl-rat LD50:14,696 mg/kg | AIHAAP American Industrial Hygiene Association Journal. 30 (1969),470. | ||
2. | ihl-rat LCLo:8000 ppm/4H | AIHAAP American Industrial Hygiene Association Journal. 30 (1969),470. | ||
3. | skn-rbt LD50:10,519 mg/kg | AIHAAP American Industrial Hygiene Association Journal. 30 (1969),470. |
Reported in EPA TSCA Inventory.
Mildly toxic by ingestion, inhalation and skin contact. A very dangerous fire hazard when exposed to HEAT or flame; can react vigorously with oxidizing materials. When HEATed to decomposition it emits acrid smoke and irritating fumes.Safety information of 1,7-Octadiene (CAS NO.3710-30-3):
Hazard Codes F,Xn
Risk Statements
11 Highly Flammable
52/53 Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment
65 Harmful: May cause lung damage if swallowed
Safety Statements
16 Keep away from sources of ignition - No smoking
61 Avoid release to the environment. Refer to special instructions safety data sheet
62 If swallowed, do not induce vomiting: seek medical advice immediately and show this container or label
RIDADR UN 2309 3/PG 2
WGK Germany 1
RTECS RG5250000
F 9
HazardClass 3
PackingGroup II
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