Conditions | Yield |
---|---|
With thionyl chloride | 80% |
With phosphorus pentachloride |
acetyl chloride
pentafluorobenzyl 2,6-dimethylphenyl ether
A
2,6-dimethylphenyl acetate
E
2,3,4,5,6-pentafluorobenzyl chloride
Conditions | Yield |
---|---|
With aluminium trichloride In dichloromethane Mechanism; Ambient temperature; or 2,6-difluorophenol; | A n/a B 25% C 41% D 17% E n/a |
acetyl chloride
pentafluorobenzyl 2,6-dimethylphenyl ether
D
2,3,4,5,6-pentafluorobenzyl chloride
Conditions | Yield |
---|---|
With aluminium trichloride In dichloromethane Ambient temperature; Further byproducts given; | A 25% B 41% C 17% D n/a |
1,2,3,4,5-pentafluoro-6-(trichloromethyl)benzene
A
2,3,4,5,6-pentafluorotoluene
B
pentafluorobenzylidene chloride
C
2,3,4,5,6-pentafluorobenzyl chloride
Conditions | Yield |
---|---|
With hydrogenchloride; zinc In water; N,N-dimethyl-formamide at 25℃; for 10h; | A 32% B 31% C 5% |
Conditions | Yield |
---|---|
With sulfuryl dichloride; dibenzoyl peroxide | |
With chlorine Irradiation; |
acetyl chloride
1-(2,6-Difluoro-phenoxymethyl)-2,3,4,5,6-pentafluoro-benzene
A
2',6'-difluorophenyl acetate
B
2,3,4,5,6-pentafluorobenzyl chloride
Conditions | Yield |
---|---|
With aluminium trichloride Yield given. Yields of byproduct given; |
1-(2,6-Difluoro-phenoxymethyl)-2,3,4,5,6-pentafluoro-benzene
A
2',6'-difluorophenyl acetate
B
2,3,4,5,6-pentafluorobenzyl chloride
Conditions | Yield |
---|---|
With aluminium trichloride; acetyl chloride Yield given. Yields of byproduct given; |
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: 97 percent / K2CO3 / acetone 2: AlCl3 View Scheme | |
Multi-step reaction with 2 steps 1: 97 percent / K2CO3 / acetone 2: AlCl3, acetyl chloride View Scheme |
Conditions | Yield |
---|---|
Multi-step reaction with 3 steps 1: (i) Mg, (ii) /BRN= 636496/ 2: LiAlH4 3: PCl5 View Scheme |
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: LiAlH4 2: PCl5 View Scheme |
Conditions | Yield |
---|---|
Multi-step reaction with 3 steps 1: (i) Mg, (ii) /BRN= 906769/ 2: LiAlH4 3: PCl5 View Scheme |
1,4-diaza-bicyclo[2.2.2]octane
2,3,4,5,6-pentafluorobenzyl chloride
C13H14F5N2(1+)*Cl(1-)
Conditions | Yield |
---|---|
In chloroform at 20℃; for 24h; | 100% |
Conditions | Yield |
---|---|
With potassium carbonate In N,N-dimethyl-formamide at 20℃; for 5h; | 90% |
Conditions | Yield |
---|---|
With potassium iodide In tetrahydrofuran at 20℃; for 24h; Inert atmosphere; | 86% |
Conditions | Yield |
---|---|
Stage #1: para-thiocresol With sodium ethanolate In ethanol at 0℃; Inert atmosphere; Stage #2: 2,3,4,5,6-pentafluorobenzyl chloride In ethanol at 0 - 20℃; | 83% |
4-hydroxy-3-methoxybenzoic acid methyl ester
2,3,4,5,6-pentafluorobenzyl chloride
C16H11F5O4
Conditions | Yield |
---|---|
With potassium carbonate In acetonitrile at 20℃; for 12h; Inert atmosphere; | 82% |
N-(2,3,4,5-pentafluorobenzyl)-hydroxylamine
2,3,4,5,6-pentafluorobenzyl chloride
N,N-bis-(2,3,4,5,6-pentafluorobenzyl)-hydroxylamine
Conditions | Yield |
---|---|
With potassium carbonate In dimethyl sulfoxide at 20℃; for 10h; | 80% |
2,3,4,5,6-pentafluorobenzyl chloride
N-(2,3,4,5-pentafluorobenzyl)-hydroxylamine
Conditions | Yield |
---|---|
With hydroxylamine hydrochloride; triethylamine In 1,4-dioxane at 110℃; for 5h; | 80% |
2,3,4,5,6-pentafluorobenzyl chloride
Conditions | Yield |
---|---|
With N-benzyl-N,N,N-triethylammonium chloride; sodium carbonate In N,N-dimethyl-formamide at 60℃; for 10h; pH=8; | 75% |
2,3,4,5,6-pentafluorobenzyl chloride
Conditions | Yield |
---|---|
With N-benzyl-N,N,N-triethylammonium chloride; sodium carbonate In acetone for 6h; pH=9; Reflux; | 71.4% |
2,3,4,5,6-pentafluorobenzyl chloride
2,3,4,5,6-pentafluorobenzylhydrazine
Conditions | Yield |
---|---|
With hydrazine In methanol at 20℃; for 2h; | 70% |
With hydrazine In methanol for 2h; Ambient temperature; | 51% |
2,3,4,5,6-pentafluorobenzyl chloride
Benzylhydrazine
N-(2,3,4,5,6-pentafluorobenzyl)-N-benzylhydrazine hydrochloride
Conditions | Yield |
---|---|
With potassium carbonate In dimethyl sulfoxide at 25 - 30℃; for 10h; | 61% |
isopropyl alcohol
2,3,4,5,6-pentafluorobenzyl chloride
L-proline
(S)-N-[(4-isopropoxytetrafluorophenyl)methyl]proline
Conditions | Yield |
---|---|
With potassium hydroxide at 20℃; for 15h; | 59% |
Conditions | Yield |
---|---|
With potassium pyrophosphate; 2-methoxy-10-(4-methoxyphenyl)-10H-phenothiazine; potassium bromide In acetonitrile at 110℃; for 48h; Suzuki Coupling; Glovebox; chemoselective reaction; | 37% |
2,3,4,5,6-pentafluorobenzyl chloride
A
2,3,4,5,6-pentafluorotoluene
B
2,2',3,3',4,4',5,5',6,6'-decafluorobibenzyl
Conditions | Yield |
---|---|
With magnesium at 600℃; under 0.01 - 0.1 Torr; | A 23% B 35% |
With copper chloride; zinc In water; N,N-dimethyl-formamide at 25℃; for 7h; | A 34% B 18% |
2,3,4,5,6-pentafluorobenzyl chloride
(C6F5CH2)2Os(CO)4
Conditions | Yield |
---|---|
In not given reaction between cluster and C6F5CH2Cl; | 30% |
2,3,4,5,6-pentafluorobenzyl chloride
Conditions | Yield |
---|---|
(i) aq. NaOH, (ii) /BRN= 647807/; Multistep reaction; |
2,3,4,5,6-pentafluorobenzyl chloride
2,3,4,5,6-pentafluorobenzyl fluoride
Conditions | Yield |
---|---|
With cesium fluoride at 250℃; | |
With potassium fluoride In N,N-dimethyl-formamide at 140℃; for 9h; Yield given; |
thiourea
2,3,4,5,6-pentafluorobenzyl chloride
S-(2,3,4,5,6-Pentafluor-benzyl)-isothioharnstoff
n-butyllithium
2,3,4,5,6-pentafluorobenzyl chloride
1-Pentafluorphenylpentan
Conditions | Yield |
---|---|
In hexane |
potassium cyanide
2,3,4,5,6-pentafluorobenzyl chloride
(pentafluorophenyl)acetonitrile
Conditions | Yield |
---|---|
In ethanol |
Conditions | Yield |
---|---|
With potassium carbonate Heating; |
1,3,4,5,6,7,8-heptafluoronaphthalene
2,3,4,5,6-pentafluorobenzyl chloride
1,2,3,4,5,6,8-Heptafluoro-7-pentafluorophenylmethyl-naphthalene
Conditions | Yield |
---|---|
With chlorosulfonic acid |
The Benzene,1-(chloromethyl)-2,3,4,5,6-pentafluoro-, with CAS registry number 653-35-0, has the systematic name of 1-(chloromethyl)-2,3,4,5,6-pentafluorobenzene. Besides this, it is also called 2,3,4,5,6-Pentafluorobenzylchloride. And the chemical formula of this chemical is C7H2ClF5. What's more, its EINECS is 211-501-0.
Physical properties of Benzene,1-(chloromethyl)-2,3,4,5,6-pentafluoro-: (1)ACD/LogP: 2.67; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.67; (4)ACD/LogD (pH 7.4): 2.67; (5)ACD/BCF (pH 5.5): 63.1; (6)ACD/BCF (pH 7.4): 63.1; (7)ACD/KOC (pH 5.5): 676.21; (8)ACD/KOC (pH 7.4): 676.21; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.434; (14)Molar Refractivity: 35.98 cm3; (15)Molar Volume: 138.1 cm3; (16)Polarizability: 14.26×10-24cm3; (17)Surface Tension: 28.1 dyne/cm; (18)Density: 1.567 g/cm3; (19)Flash Point: 55.3 °C; (20)Enthalpy of Vaporization: 37.92 kJ/mol; (21)Boiling Point: 158.8 °C at 760 mmHg; (22)Vapour Pressure: 3.34 mmHg at 25°C.
Preparation: this chemical can be prepared by 2,3,4,5,6-pentafluoro-benzenemethanol. This reaction will need reagent SOCl2. The yield is about 80%.
Uses of Benzene,1-(chloromethyl)-2,3,4,5,6-pentafluoro-: it can be used to produce pentafluorobenzylhydrazine. This reaction will need reagent hydrazine and solvent methanol. The reaction time is 2 hour(s) with reaction temperature of 20 ℃. The yield is about 70%.
When you are using this chemical, please be cautious about it as the following:
The Benzene,1-(chloromethyl)-2,3,4,5,6-pentafluoro- may cause burns. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1c(c(F)c(F)c(F)c1F)CCl
(2)InChI: InChI=1/C7H2ClF5/c8-1-2-3(9)5(11)7(13)6(12)4(2)10/h1H2
(3)InChIKey: ZLNVRXFZTPRLIK-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C7H2ClF5/c8-1-2-3(9)5(11)7(13)6(12)4(2)10/h1H2
(5)Std. InChIKey: ZLNVRXFZTPRLIK-UHFFFAOYSA-N
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