4-Ethylbenzyl chloride supplier

Name
4-Ethylbenzyl chloride
EINECS
CAS No. 1467-05-6
Article Data37
CAS DataBase
Density 1.031 g/cm³
Solubility Insoluble in water.
Melting Point -21°C
Formula C₉H₁₁Cl
Boiling Point 217.1 °C at 760 mmHg
Molecular Weight 154.639
Flash Point 83.5 °C
Transport Information 1760
Appearance
Safety 26-36/37/39
Risk Codes 34
Molecular Structure
Hazard Symbols Xi
Synonyms Toluene, a-chloro-p-ethyl- (6CI,7CI,8CI);1-Chloromethyl-4-ethylbenzene;4-(Chloromethyl)-1-ethylbenzene;4-Ethylbenzylchloride;p-Chloromethylethylbenzene;p-Ethylbenzyl chloride;a-Chloro-p-ethyltoluene;
PSA 0.00000
LogP 2.98780

Synthetic route

: 109-87-5
Dimethoxymethane

: 100-41-4
ethylbenzene

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
Stage #1: Dimethoxymethane With chlorosulfonic acid; zinc(II) iodide In dichloromethane at -10℃; for 0.5h; Stage #2: ethylbenzene In dichloromethane at 5 - 10℃; for 1h;	87%
Stage #1: Dimethoxymethane With chlorosulfonic acid; zinc(II) chloride at -10℃; for 0.5h; Stage #2: ethylbenzene at 5 - 10℃; for 3h;	77%

: 768-59-2
4-ethylbenzyl alcohol

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
With thionyl chloride In benzene Heating;	73%
With hydrogenchloride
With pyridine; phosphorus trichloride In diethyl ether

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
With hydrogenchloride; zinc(II) chloride at 65 - 70℃;
With hydrogenchloride; zinc(II) chloride
With hydrogenchloride; phosphoric acid; acetic acid at 100℃;

: 100-41-4
ethylbenzene

: 107-30-2
chloromethyl methyl ether

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
With tin(IV) chloride
With tetrachloromethane; tin(IV) chloride at -10℃;

: 100-41-4
ethylbenzene

: 107-30-2
chloromethyl methyl ether

: 64-19-7
acetic acid

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
at 100℃;

...Expand

: 100-41-4
ethylbenzene

: 7646-78-8
tin(IV) chloride

: 107-30-2
chloromethyl methyl ether

: 1467-05-6
4-ethylbenzylchloride

...Expand

: 7647-01-0
hydrogenchloride

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

: 86119-84-8, 7664-38-2
phosphoric acid

: 64-19-7
acetic acid

: 1467-05-6
4-ethylbenzylchloride

...Expand

: 7647-01-0
hydrogenchloride

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

: 5435-44-9, 22243-66-9
(E)-3-Ureido-but-2-enoic acid ethyl ester

: 1467-05-6
4-ethylbenzylchloride

...Expand

: 7647-01-0
hydrogenchloride

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

: 5435-44-9, 22243-66-9
(E)-3-Ureido-but-2-enoic acid ethyl ester

A: 1467-05-6
4-ethylbenzylchloride

B: 1467-06-7
2-ethylbenzyl chloride

Conditions

Conditions	Yield
Product distribution;

...Expand

: 7647-01-0
hydrogenchloride

: 56-23-5
tetrachloromethane

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

: 5435-44-9, 22243-66-9
(E)-3-Ureido-but-2-enoic acid ethyl ester

A: 1467-05-6
4-ethylbenzylchloride

B: 1467-06-7
2-ethylbenzyl chloride

Conditions

Conditions	Yield
Product distribution;

...Expand

: 7647-01-0
hydrogenchloride

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

A: 1467-05-6
4-ethylbenzylchloride

B: 1467-06-7
2-ethylbenzyl chloride

Conditions

Conditions	Yield
Product distribution;

...Expand

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

A: 2,4-bis(chloromethyl)-1-ethylbenzene

B: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
With hydrogenchloride for 2h; Heating; Title compound not separated from byproducts.;

...Expand

: 622-96-8
4-methylethylbenzene

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
With hydrogenchloride; formaldehyd for 2h; Heating;

: 619-64-7
p-ethylbenzoic acid

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 92 percent / LiAlH4 2: 73 percent / thionyl chloride / benzene / Heating View Scheme

: 100-41-4
ethylbenzene

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: hydrogen chloride; benzene; aluminium chloride / weit. Reagens: Kupfer(I)-chlorid 2: concentrated KOH-solution 3: concentrated hydrochloric acid View Scheme

: 4748-78-1
4-ethylbenzylaldehyde

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: concentrated KOH-solution 2: concentrated hydrochloric acid View Scheme

: 1592-20-7
4-Vinylbenzyl chloride

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
With hydrogen In water at 35℃; under 760.051 Torr; for 2h;
With ammonium hydroxide; hydrazine hydrate In ethanol at 20℃;	63 %Chromat.

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

A: 1467-05-6
4-ethylbenzylchloride

B: 1467-06-7
2-ethylbenzyl chloride

Conditions

Conditions	Yield
With hydrogenchloride; sulfuric acid; acetic acid; zinc(II) chloride In water at 50℃; for 8h;	A 73 %Chromat. B 9 %Chromat.
With hydrogenchloride; zinc(II) chloride at 60℃; for 6h;
With hydrogenchloride; sulfuric acid; tetrabutylammomium bromide In water at 50℃; for 20h;

...Expand

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

A: 55190-53-9
3-ethylbenzyl chloride

B: 1467-05-6
4-ethylbenzylchloride

C: 1467-06-7
2-ethylbenzyl chloride

Conditions

Conditions	Yield
With hydrogenchloride; sulfuric acid; tetrabutylammomium bromide In water at 115℃; for 5h; Reagent/catalyst; Temperature; Overall yield = 92 %;

...Expand

: 7368-78-7
4-bromoguaiacol

: 1467-05-6
4-ethylbenzylchloride

: 1255305-53-3
4-bromo-1-(4-ethylbenzyloxy)-2-methoxybenzene

Conditions

Conditions	Yield
With potassium carbonate In N,N-dimethyl-formamide at 80℃; for 1h;	99%

: 1467-05-6
4-ethylbenzylchloride

: 768-59-2
4-ethylbenzyl alcohol

Conditions

Conditions	Yield
With iron(III) sulfate; water In toluene at 110℃; for 0.7h; Ionic liquid;	96%
With potassium carbonate; acetone

: 1467-05-6
4-ethylbenzylchloride

: 17356-08-0
thiourea

: 64732-32-7
S-(4-ethylbenzyl)isothiourea hydrochloride

Conditions

Conditions	Yield
In ethanol at 60℃; for 5h;	95%

: 1467-05-6
4-ethylbenzylchloride

: 7440-66-6
zinc

: C9H11ClZn

Conditions

Conditions	Yield
Stage #1: 4-ethylbenzylchloride With chloro-trimethyl-silane In tetrahydrofuran; ethylene dibromide at 60 - 70℃; Inert atmosphere; Stage #2: zinc In tetrahydrofuran; ethylene dibromide for 3h;	95%

: 33543-78-1
ethyl 1H-imidazole-2-carboxylate

: 1467-05-6
4-ethylbenzylchloride

: 1-(4-ethylbenzyl)-1H-imidazole-2-carboxylic acid ethyl ester

Conditions

Conditions	Yield
Stage #1: ethyl 1H-imidazole-2-carboxylate With caesium carbonate In acetonitrile for 0.5h; Stage #2: 4-ethylbenzylchloride In acetonitrile at 60℃; for 4h;	92.3%
Stage #1: ethyl 1H-imidazole-2-carboxylate With caesium carbonate In acetonitrile for 0.5h; Stage #2: 4-ethylbenzylchloride In acetonitrile at 60℃; for 4h;	92.3%

: 1260230-40-7
5-(4-methyl-1,2,3-thiadiazol-5-yl)-4-phenyl-4H-1,2,4-triazole-3-thiol

: 1467-05-6
4-ethylbenzylchloride

: 1417895-59-0
4-methyl-5-(5-((4-ethylbenzyl)thio)-4-phenyl-4H-1,2,4-triazol-3-yl)-1,2,3-thiadiazole

Conditions

Conditions	Yield
With potassium carbonate In N,N-dimethyl-formamide at 90℃; under 10343.2 Torr; for 0.25h; Microwave irradiation;	89%

: 203861-62-5
2-methoxy-4-iodophenol

: 1467-05-6
4-ethylbenzylchloride

: 1255305-47-5
1-(4-ethylbenzyloxy)-4-iodo-2-methoxybenzene

Conditions

Conditions	Yield
With potassium carbonate In N,N-dimethyl-formamide at 20 - 80℃; for 3h;	87%
With potassium carbonate In N,N-dimethyl-formamide at 80℃; for 3h;	87%

: 201230-82-2
carbon monoxide

: 1467-05-6
4-ethylbenzylchloride

: 14387-10-1
(4-ethyl-phenyl)-acetic acid

Conditions

Conditions	Yield
Stage #1: carbon monoxide With C28H22CoN4O6 In butan-1-ol at 60℃; under 760.051 Torr; for 2h; Glovebox; High pressure; Green chemistry; Stage #2: 4-ethylbenzylchloride With tetra-(n-butyl)ammonium iodide; sodium hydroxide In butan-1-ol at 60℃; under 760.051 Torr; for 22h; Glovebox; High pressure; Green chemistry; regioselective reaction;	84%

: 1467-05-6
4-ethylbenzylchloride

: 14387-10-1
(4-ethyl-phenyl)-acetic acid

Conditions

Conditions	Yield
With sodium hydroxide; cobalt tetracarbonyl anion In methanol at 50℃; for 4h;	80%
Multi-step reaction with 2 steps 1: ethanol 2: 70 percent aqueous sulfuric acid View Scheme
Multi-step reaction with 2 steps 1: aqueous ethanol 2: 60 percent aqueous sulfuric acid View Scheme

: 1417710-45-2
methyl 3-{[5-(methoxymethoxy)-1-(methoxymethyl)-6-oxo-1,6-dihydropyridin-3-yl]sulfanyl}propanoate

: 1467-05-6
4-ethylbenzylchloride

: 1417710-46-3
5-[(4-ethylbenzyl)sulfanyl]-3-(methoxymethoxy)-1-(methoxymethyl)pyridin-2(1H)-one

Conditions

Conditions	Yield
Stage #1: methyl 3-{[5-(methoxymethoxy)-1-(methoxymethyl)-6-oxo-1,6-dihydropyridin-3-yl]sulfanyl}propanoate With potassium tert-butylate In tetrahydrofuran at -45℃; Stage #2: 4-ethylbenzylchloride In tetrahydrofuran at 20℃; for 4h;	79%
Stage #1: methyl 3-{[5-(methoxymethoxy)-1-(methoxymethyl)-6-oxo-1,6-dihydropyridin-3-yl]sulfanyl}propanoate With potassium tert-butylate In tetrahydrofuran at -45℃; for 0.333333h; Stage #2: 4-ethylbenzylchloride In tetrahydrofuran at 20℃; for 4h;	79%

: 1467-05-6
4-ethylbenzylchloride

: 91419-52-2
1-tert-butoxycarbonyl-4-cyanopiperidine

: tert-butyl 4-cyano-4-(4-ethylbenzyl)piperidine-1-carboxylate

Conditions

Conditions	Yield
Stage #1: 1-tert-butoxycarbonyl-4-cyanopiperidine With lithium diisopropyl amide In tetrahydrofuran; n-heptane at -70℃; for 1h; Inert atmosphere; Stage #2: 4-ethylbenzylchloride In tetrahydrofuran; n-heptane at 25℃; for 16h; Inert atmosphere;	77.8%

: 1467-05-6
4-ethylbenzylchloride

: 72824-04-5
2-Allyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

: 3-allyl-3-ethyl-6-methylenecyclohexa-1,4-diene

Conditions

Conditions	Yield
With tris-(dibenzylideneacetone)dipalladium(0); triphenylphosphine; cesium fluoride In dichloromethane at 30℃; for 24h; Inert atmosphere; regioselective reaction;	76%

: 64-18-6
formic acid

: 1467-05-6
4-ethylbenzylchloride

: 14387-10-1
(4-ethyl-phenyl)-acetic acid

Conditions

Conditions	Yield
With N,N,N,N,-tetramethylethylenediamine; α,α′-bis(2-pyridyl(tert-butyl)phosphino)-o-xylene; palladium diacetate In N,N-dimethyl-formamide at 115℃; for 12h; Inert atmosphere;	76%

: 1194341-42-8
4-amino-2-chloropyridine-3-carbonitrile

: 1467-05-6
4-ethylbenzylchloride

: 1-(4-amino-2-chloropyridin-3-yl)-2-(4-ethylphenyl)ethan-1-one

Conditions

Conditions	Yield
Stage #1: 4-ethylbenzylchloride With iodine; magnesium In diethyl ether for 2h; Stage #2: 4-amino-2-chloropyridine-3-carbonitrile In diethyl ether at 30℃; for 12h; Inert atmosphere; Stage #3: With hydrogenchloride; water In diethyl ether; ethanol at 0℃; for 2h; Inert atmosphere; Reflux;	75%

: 109-87-5
Dimethoxymethane

: 100-41-4
ethylbenzene

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
Stage #1: Dimethoxymethane With chlorosulfonic acid; zinc(II) iodide In dichloromethane at -10℃; for 0.5h; Stage #2: ethylbenzene In dichloromethane at 5 - 10℃; for 1h;	87%
Stage #1: Dimethoxymethane With chlorosulfonic acid; zinc(II) chloride at -10℃; for 0.5h; Stage #2: ethylbenzene at 5 - 10℃; for 3h;	77%

: 768-59-2
4-ethylbenzyl alcohol

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
With thionyl chloride In benzene Heating;	73%
With hydrogenchloride
With pyridine; phosphorus trichloride In diethyl ether

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
With hydrogenchloride; zinc(II) chloride at 65 - 70℃;
With hydrogenchloride; zinc(II) chloride
With hydrogenchloride; phosphoric acid; acetic acid at 100℃;

: 100-41-4
ethylbenzene

: 107-30-2
chloromethyl methyl ether

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
With tin(IV) chloride
With tetrachloromethane; tin(IV) chloride at -10℃;

: 100-41-4
ethylbenzene

: 107-30-2
chloromethyl methyl ether

: 64-19-7
acetic acid

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
at 100℃;

...Expand

: 100-41-4
ethylbenzene

: 7646-78-8
tin(IV) chloride

: 107-30-2
chloromethyl methyl ether

: 1467-05-6
4-ethylbenzylchloride

...Expand

: 7647-01-0
hydrogenchloride

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

: 86119-84-8, 7664-38-2
phosphoric acid

: 64-19-7
acetic acid

: 1467-05-6
4-ethylbenzylchloride

...Expand

: 7647-01-0
hydrogenchloride

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

: 5435-44-9, 22243-66-9
(E)-3-Ureido-but-2-enoic acid ethyl ester

: 1467-05-6
4-ethylbenzylchloride

...Expand

: 7647-01-0
hydrogenchloride

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

: 5435-44-9, 22243-66-9
(E)-3-Ureido-but-2-enoic acid ethyl ester

A: 1467-05-6
4-ethylbenzylchloride

B: 1467-06-7
2-ethylbenzyl chloride

Conditions

Conditions	Yield
Product distribution;

...Expand

: 7647-01-0
hydrogenchloride

: 56-23-5
tetrachloromethane

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

: 5435-44-9, 22243-66-9
(E)-3-Ureido-but-2-enoic acid ethyl ester

A: 1467-05-6
4-ethylbenzylchloride

B: 1467-06-7
2-ethylbenzyl chloride

Conditions

Conditions	Yield
Product distribution;

...Expand

: 7647-01-0
hydrogenchloride

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

A: 1467-05-6
4-ethylbenzylchloride

B: 1467-06-7
2-ethylbenzyl chloride

Conditions

Conditions	Yield
Product distribution;

...Expand

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

A: 2,4-bis(chloromethyl)-1-ethylbenzene

B: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
With hydrogenchloride for 2h; Heating; Title compound not separated from byproducts.;

...Expand

: 622-96-8
4-methylethylbenzene

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
With hydrogenchloride; formaldehyd for 2h; Heating;

: 619-64-7
p-ethylbenzoic acid

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 92 percent / LiAlH4 2: 73 percent / thionyl chloride / benzene / Heating View Scheme

: 100-41-4
ethylbenzene

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: hydrogen chloride; benzene; aluminium chloride / weit. Reagens: Kupfer(I)-chlorid 2: concentrated KOH-solution 3: concentrated hydrochloric acid View Scheme

: 4748-78-1
4-ethylbenzylaldehyde

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: concentrated KOH-solution 2: concentrated hydrochloric acid View Scheme

: 1592-20-7
4-Vinylbenzyl chloride

: 1467-05-6
4-ethylbenzylchloride

Conditions

Conditions	Yield
With hydrogen In water at 35℃; under 760.051 Torr; for 2h;
With ammonium hydroxide; hydrazine hydrate In ethanol at 20℃;	63 %Chromat.

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

A: 1467-05-6
4-ethylbenzylchloride

B: 1467-06-7
2-ethylbenzyl chloride

Conditions

Conditions	Yield
With hydrogenchloride; sulfuric acid; acetic acid; zinc(II) chloride In water at 50℃; for 8h;	A 73 %Chromat. B 9 %Chromat.
With hydrogenchloride; zinc(II) chloride at 60℃; for 6h;
With hydrogenchloride; sulfuric acid; tetrabutylammomium bromide In water at 50℃; for 20h;

...Expand

: 50-00-0
formaldehyd

: 100-41-4
ethylbenzene

A: 55190-53-9
3-ethylbenzyl chloride

B: 1467-05-6
4-ethylbenzylchloride

C: 1467-06-7
2-ethylbenzyl chloride

Conditions

Conditions	Yield
With hydrogenchloride; sulfuric acid; tetrabutylammomium bromide In water at 115℃; for 5h; Reagent/catalyst; Temperature; Overall yield = 92 %;

...Expand

: 7368-78-7
4-bromoguaiacol

: 1467-05-6
4-ethylbenzylchloride

: 1255305-53-3
4-bromo-1-(4-ethylbenzyloxy)-2-methoxybenzene

Conditions

Conditions	Yield
With potassium carbonate In N,N-dimethyl-formamide at 80℃; for 1h;	99%

: 1467-05-6
4-ethylbenzylchloride

: 768-59-2
4-ethylbenzyl alcohol

Conditions

Conditions	Yield
With iron(III) sulfate; water In toluene at 110℃; for 0.7h; Ionic liquid;	96%
With potassium carbonate; acetone

: 1467-05-6
4-ethylbenzylchloride

: 17356-08-0
thiourea

: 64732-32-7
S-(4-ethylbenzyl)isothiourea hydrochloride

Conditions

Conditions	Yield
In ethanol at 60℃; for 5h;	95%

: 1467-05-6
4-ethylbenzylchloride

: 7440-66-6
zinc

: C9H11ClZn

Conditions

Conditions	Yield
Stage #1: 4-ethylbenzylchloride With chloro-trimethyl-silane In tetrahydrofuran; ethylene dibromide at 60 - 70℃; Inert atmosphere; Stage #2: zinc In tetrahydrofuran; ethylene dibromide for 3h;	95%

: 33543-78-1
ethyl 1H-imidazole-2-carboxylate

: 1467-05-6
4-ethylbenzylchloride

: 1-(4-ethylbenzyl)-1H-imidazole-2-carboxylic acid ethyl ester

Conditions

Conditions	Yield
Stage #1: ethyl 1H-imidazole-2-carboxylate With caesium carbonate In acetonitrile for 0.5h; Stage #2: 4-ethylbenzylchloride In acetonitrile at 60℃; for 4h;	92.3%
Stage #1: ethyl 1H-imidazole-2-carboxylate With caesium carbonate In acetonitrile for 0.5h; Stage #2: 4-ethylbenzylchloride In acetonitrile at 60℃; for 4h;	92.3%

: 1260230-40-7
5-(4-methyl-1,2,3-thiadiazol-5-yl)-4-phenyl-4H-1,2,4-triazole-3-thiol

: 1467-05-6
4-ethylbenzylchloride

: 1417895-59-0
4-methyl-5-(5-((4-ethylbenzyl)thio)-4-phenyl-4H-1,2,4-triazol-3-yl)-1,2,3-thiadiazole

Conditions

Conditions	Yield
With potassium carbonate In N,N-dimethyl-formamide at 90℃; under 10343.2 Torr; for 0.25h; Microwave irradiation;	89%

: 203861-62-5
2-methoxy-4-iodophenol

: 1467-05-6
4-ethylbenzylchloride

: 1255305-47-5
1-(4-ethylbenzyloxy)-4-iodo-2-methoxybenzene

Conditions

Conditions	Yield
With potassium carbonate In N,N-dimethyl-formamide at 20 - 80℃; for 3h;	87%
With potassium carbonate In N,N-dimethyl-formamide at 80℃; for 3h;	87%

: 201230-82-2
carbon monoxide

: 1467-05-6
4-ethylbenzylchloride

: 14387-10-1
(4-ethyl-phenyl)-acetic acid

Conditions

Conditions	Yield
Stage #1: carbon monoxide With C28H22CoN4O6 In butan-1-ol at 60℃; under 760.051 Torr; for 2h; Glovebox; High pressure; Green chemistry; Stage #2: 4-ethylbenzylchloride With tetra-(n-butyl)ammonium iodide; sodium hydroxide In butan-1-ol at 60℃; under 760.051 Torr; for 22h; Glovebox; High pressure; Green chemistry; regioselective reaction;	84%

4-Ethylbenzyl chloride Specification

This chemical is called Benzene,1-(chloromethyl)-4-ethyl-, and its systematic name is 1-(chloromethyl)-4-ethylbenzene. With the molecular formula of C₉H₁₁Cl, its molecular weight is 154.64. The CAS registry number of this chemical is 1467-05-6. In addition, this chemical should be sealed in the cool and dry place, away from oxides.

Other characteristics of the Benzene,1-(chloromethyl)-4-ethyl- can be summarised as followings: (1)ACD/LogP: 3.48; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.48; (4)ACD/LogD (pH 7.4): 3.48; (5)ACD/BCF (pH 5.5): 259.14; (6)ACD/BCF (pH 7.4): 259.14; (7)ACD/KOC (pH 5.5): 1858.7; (8)ACD/KOC (pH 7.4): 1858.7; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Index of Refraction: 1.519; (13)Molar Refractivity: 45.56 cm3; (14)Molar Volume: 149.9 cm³; (15)Polarizability: 18.06×10^-24cm³; (16)Surface Tension: 32.9 dyne/cm; (17)Density: 1.031 g/cm³; (18)Flash Point: 83.5 °C; (19)Enthalpy of Vaporization: 43.5 kJ/mol; (20)Boiling Point: 217.1 °C at 760 mmHg; (21)Vapour Pressure: 0.198 mmHg at 25°C.

Production method of this chemical: The Benzene,1-(chloromethyl)-4-ethyl- could be obtained by the reactant of 4-ethyl-benzyl alcohol. This reaction needs the reagent of PCl₃, pyridine, and the solvent of diethyl ether.

Uses of this chemical: The Benzene,1-(chloromethyl)-4-ethyl- could react with hydrocyanic acid; sodium salt, and obtain the (4-ethyl-phenyl)-acetonitrile. This reaction needs the solvent of dimethylsulfoxide. The yield is 72.4 %.

When you are using this chemical, please be cautious about it as the following: This chemical causes burns. You should wear suitable protective clothing if you use it.

You can still convert the following datas into molecular structure:
1.SMILES: ClCc1ccc(cc1)CC
2.InChI: InChI=1/C9H11Cl/c1-2-8-3-5-9(7-10)6-4-8/h3-6H,2,7H2,1H3
3.InChIKey: DUBCVXSYZVTCOC-UHFFFAOYAO

Product Name

4-Ethylbenzyl chloride

Synthetic route

4-Ethylbenzyl chloride Specification

Related Products

Hot Products