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456-42-8

Basic Information
CAS No.: 456-42-8
Name: Benzene,1-(chloromethyl)-3-fluoro-
Molecular Structure:
Molecular Structure of 456-42-8 (Benzene,1-(chloromethyl)-3-fluoro-)
Formula: C7H6ClF
Molecular Weight: 144.57
Synonyms: a-Chloro-m-fluorotoluene;Toluene,a-chloro-m-fluoro- (6CI,7CI,8CI);1-(Chloromethyl)-3-fluorobenzene;3-Fluorophenylmethylchloride;NSC 60720;m-Fluorobenzyl chloride;a-Chloro-3-fluorotoluene;
EINECS: 207-264-8
Density: 1.191 g/cm3
Melting Point: 34.5-36 °C
Boiling Point: 173.3 °C at 760 mmHg
Flash Point: 58.9 °C
Solubility: 40 g/L (20 °C) in water
Appearance: Colorless to light yellow liquid
Hazard Symbols: CorrosiveC
Risk Codes: 34-37
Safety: 26-36/37/39-45
Transport Information:
PSA: 0.00000
LogP: 2.56450
Synthetic route
352-70-5

m-Fluorotoluene

456-42-8

m-fluorobenzyl chloride

Conditions
ConditionsYield
With methanol; tetrachloromethane; iron(II) chloride tetrahydrate; formamide at 180℃; for 6h; Reagent/catalyst; Inert atmosphere; Sealed tube; Autoclave; chemoselective reaction;35%
at 147℃; Irradiation.Einleiten von Chlor;
at 147℃; Einleiten von Chlor;
352-70-5

m-Fluorotoluene

A

402-64-2

1-dichloromethyl-3-fluoro-benzene

B

456-42-8

m-fluorobenzyl chloride

Conditions
ConditionsYield
Chlorierung;
456-47-3

3-fluoro-benzenemethanol

456-42-8

m-fluorobenzyl chloride

Conditions
ConditionsYield
With pyridine; thionyl chloride
28490-56-4

1-fluoro-3-(iodomethyl)benzene

456-42-8

m-fluorobenzyl chloride

Conditions
ConditionsYield
With pyridine; tributyltin chloride at 50℃; Thermodynamic data; Equilibrium constant; Δ G;28 % Spectr.
65108-06-7

m-fluorobenzyl ion

456-42-8

m-fluorobenzyl chloride

Conditions
ConditionsYield
With tertiary butyl chloride In gaseous matrix at 600℃; chloride affinity;
456-41-7

1-(Bromomethyl)-3-fluorobenzene

456-42-8

m-fluorobenzyl chloride

Conditions
ConditionsYield
With pyridine; tributyltin chloride at 50℃; Thermodynamic data; Equilibrium constant; Δ G;65 % Spectr.
100-11-8

1-bromomethyl-4-nitro-benzene

456-42-8

m-fluorobenzyl chloride

Conditions
ConditionsYield
With pyridine; tributyltin chloride at 50℃; Thermodynamic data; Equilibrium constant; Δ G;65 % Spectr.
394-54-7

1-(1-chloro-2,2,2-trifluoroethyl)-4-chlorobenzene

65108-06-7

m-fluorobenzyl ion

A

128408-33-3

C8H5ClF3(1+)

B

456-42-8

m-fluorobenzyl chloride

Conditions
ConditionsYield
at 69.85℃; Thermodynamic data; chloride-transfer;
191402-55-8

1-(1-Chloro-2,2,2-trifluoro-ethyl)-3-methyl-benzene

65108-06-7

m-fluorobenzyl ion

A

128408-28-6

C9H8F3(1+)

B

456-42-8

m-fluorobenzyl chloride

Conditions
ConditionsYield
at 69.85℃; Thermodynamic data; chloride-transfer;
81577-13-1

1-(1-Chloro-2,2,2-trifluoro-ethyl)-4-fluoro-benzene

65108-06-7

m-fluorobenzyl ion

A

128408-32-2

C8H5F4(1+)

B

456-42-8

m-fluorobenzyl chloride

Conditions
ConditionsYield
at 69.85℃; Thermodynamic data; chloride-transfer;

2-Chloro-4-(1-chloro-2,2,2-trifluoro-ethyl)-1-methyl-benzene

65108-06-7

m-fluorobenzyl ion

A

128408-27-5

C9H7ClF3(1+)

B

456-42-8

m-fluorobenzyl chloride

Conditions
ConditionsYield
at 69.85℃; Thermodynamic data; chloride-transfer;
3-fluoro-toluene-vapour

3-fluoro-toluene-vapour

456-42-8

m-fluorobenzyl chloride

Conditions
ConditionsYield
With chlorine
1178094-73-9

(Z)-6-methoxy-2-(pyridin-4-ylmethylene)benzofuran-3(2H)-one

456-42-8

m-fluorobenzyl chloride

1250364-30-7

(Z)-1-(3-fluorobenzyl)-4-((6-methoxy-3-oxobenzofuran-2(3H)-ylidene)methyl)pyridinium chloride

Conditions
ConditionsYield
In acetonitrile Reflux;100%
1250364-18-1

(Z)-6-ethoxy-2-(pyridin-4-ylmethylene)benzofuran-3(2H)-one

456-42-8

m-fluorobenzyl chloride

1250364-43-2

(Z)-1-(3-fluorobenzyl)-4-((6-ethoxy-3-oxobenzofuran-2(3H)-ylidene)methyl)pyridinium chloride

Conditions
ConditionsYield
In acetonitrile Reflux;100%
1250364-19-2

(Z)-6-propoxy-2-(pyridin-4-ylmethylene)benzofuran-3(2H)-one

456-42-8

m-fluorobenzyl chloride

1250364-55-6

(Z)-1-(3-fluorobenzyl)-4-((6-propoxy-3-oxobenzofuran-2(3H)-ylidene)methyl)pyridinium chloride

Conditions
ConditionsYield
In acetonitrile Reflux;100%
68-11-1

mercaptoacetic acid

456-42-8

m-fluorobenzyl chloride

2-(3-fluorobenzylthio)acetic acid

Conditions
ConditionsYield
With sodium hydroxide In methanol at 20℃; for 1h;98.1%
124-38-9

carbon dioxide

456-42-8

m-fluorobenzyl chloride

331-25-9

(3-fluorophenyl)acetic acid

Conditions
ConditionsYield
With dicyclohexyl-(2',6'-dimethoxybiphenyl-2-yl)-phosphane; manganese; palladium diacetate; magnesium chloride In N,N-dimethyl-formamide under 760.051 Torr; for 12h; Inert atmosphere; Schlenk technique;96%
456-42-8

m-fluorobenzyl chloride

214326-07-5

C19H22Cl3NO3

214325-98-1

C26H27Cl3FNO3

Conditions
ConditionsYield
With potassium carbonate In ethanol Heating;95%
123-08-0

4-hydroxy-benzaldehyde

456-42-8

m-fluorobenzyl chloride

66742-57-2

4-(3-fluoro-benzyloxy)-benzaldehyde

Conditions
ConditionsYield
With potassium carbonate; sodium iodide In ethanol for 5.41667h; Product distribution / selectivity; Heating / reflux;95%
With sodium hydroxide In ethanol for 6.75h; Product distribution / selectivity; Heating / reflux;95%
With potassium carbonate; sodium iodide In ethanol for 5.41667h; Product distribution / selectivity; Heating / reflux;95%
456-42-8

m-fluorobenzyl chloride

128564-78-3

(E)-3-(pyridin-4-ylmethylene)indolin-2-one

1621102-53-1

(E)-1-(3-fluorobenzyl)-4-((2-oxoindolin-3-ylidene)methyl)pyridinium chloride

Conditions
ConditionsYield
In acetonitrile at 60 - 70℃;95%
137-07-5

2-amino-benzenethiol

456-42-8

m-fluorobenzyl chloride

1629-07-8

2-(3-fluorophenyl)benzo[d]thiazole

Conditions
ConditionsYield
With pyridine; sulfur at 130℃; for 20h; Inert atmosphere;95%
88-73-3

2-Chloronitrobenzene

456-42-8

m-fluorobenzyl chloride

1629-07-8

2-(3-fluorophenyl)benzo[d]thiazole

Conditions
ConditionsYield
With N-methylcyclohexylamine; sulfur at 110℃; for 24h; Sealed tube; Inert atmosphere;95%
456-42-8

m-fluorobenzyl chloride

C44H45FN2O6*2HCl

Conditions
ConditionsYield
Stage #1: demethyltetrandrine; m-fluorobenzyl chloride With tetrabutylammomium bromide In water at 120℃; for 1h; Sonication;
Stage #2: With hydrogenchloride In water Reagent/catalyst; Solvent; Temperature; Molecular sieve;
94.77%
76352-25-5

2-amino-4-methoxy-N-(8-azabicyclo<3,2,1>oct-3 β-yl)-5-pyrimidine carboxamide

456-42-8

m-fluorobenzyl chloride

84922-97-4

2-Amino-4-methoxy-pyrimidine-5-carboxylic acid [(1R,3S,5S)-8-(3-fluoro-benzyl)-8-aza-bicyclo[3.2.1]oct-3-yl]-amide

Conditions
ConditionsYield
With potassium carbonate In acetone for 36h; Heating;94%
456-42-8

m-fluorobenzyl chloride

251940-05-3

1-(4-fluoro-phenyl)-2-(tetrahydro-pyrimidin-2-ylidene)-ethanone

3-(3'-fluorophenyl)-1-(4'-fluoro-phenyl)-2-(tetrahydropyrimidin-2'-ylidene)-propan-1-one

Conditions
ConditionsYield
In toluene at 65℃; for 2h;94%
16101-63-6

6,7-dimethoxyisoquinoline-1(2H)-one

456-42-8

m-fluorobenzyl chloride

2-(3-fluorobenzyl)-6,7-dimethoxyisoquinolin-1(2H)-one

Conditions
ConditionsYield
With sodium hydride In N,N-dimethyl-formamide at 20℃; for 0.5h; Inert atmosphere;93.1%
82100-30-9

1-phenyl-2-(tetrahydropyrimidin-2(1H)-ylidene)ethan-1-one

456-42-8

m-fluorobenzyl chloride

3-(3'-fluoro-phenyl)-1-phenyl-2-(tetrahydropyrimidin-2'-ylidene)-propan-1-one

Conditions
ConditionsYield
In toluene at 60℃; for 2h;93%
1146443-78-8

N,2,5-trimethoxy-N-methylbenzamide

456-42-8

m-fluorobenzyl chloride

1097077-65-0

1-(2,5-dimethoxyphenyl)-2-(3-fluorophenyl)ethanone

Conditions
ConditionsYield
Stage #1: m-fluorobenzyl chloride With magnesium In diethyl ether at 0 - 20℃; for 4h;
Stage #2: N,2,5-trimethoxy-N-methylbenzamide In tetrahydrofuran; diethyl ether at 0℃; for 1h;
93%
Stage #1: m-fluorobenzyl chloride With iodine; magnesium In tetrahydrofuran at 0℃;
Stage #2: N,2,5-trimethoxy-N-methylbenzamide In tetrahydrofuran at 0℃; for 1h;

2‐amino‐4‐(pyridin‐4‐yl)‐5‐oxo‐4H,5H‐pyrano[3,2‐c]chromene‐3‐carbonitrile

456-42-8

m-fluorobenzyl chloride

4-(2-amino-3-cyano-5-oxo-4,5-dihydropyrano[3,2-c]chromen-4-yl)-1-(3-fluorobenzyl)pyridinium chloride

Conditions
ConditionsYield
With potassium iodide In acetonitrile Reflux;93%
22841-91-4

8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3(2H)-thione

456-42-8

m-fluorobenzyl chloride

8-chloro-3-((3-fluorobenzyl)thio)-[1,2,4]triazolo[4,3-a]pyridine

Conditions
ConditionsYield
With sodium hydroxide In N,N-dimethyl-formamide at 90℃; for 0.25h; Microwave irradiation;93%
With sodium hydroxide In N,N-dimethyl-formamide at 90℃; for 0.25h; Microwave irradiation;81%
615-43-0

2-iodophenylamine

456-42-8

m-fluorobenzyl chloride

1629-07-8

2-(3-fluorophenyl)benzo[d]thiazole

Conditions
ConditionsYield
With copper(II) acetate monohydrate; sodium carbonate; sulfur In dimethyl sulfoxide at 130℃; for 24h; Schlenk technique; Inert atmosphere;93%
27386-01-2

2-methylamino-5-mercapto-1,3,4-thiadiazole

456-42-8

m-fluorobenzyl chloride

97773-03-0

2-(3-fluorobenzylthio)-5-methylamino-1,3,4-thiadiazole

Conditions
ConditionsYield
With potassium hydroxide In methanol for 0.5h; Ambient temperature;92%
95-92-1

oxalic acid diethyl ester

456-42-8

m-fluorobenzyl chloride

3-(3-fluorophenyl)-2-oxopropionic acid ethyl ester

Conditions
ConditionsYield
Stage #1: m-fluorobenzyl chloride With magnesium In diethyl ether for 0.166667h; Heating;
Stage #2: oxalic acid diethyl ester In diethyl ether at 20℃; for 2h; Grignard reaction;
92%
918156-44-2

CH3C6H3OCHCNC(CONH)

456-42-8

m-fluorobenzyl chloride

CH3C6H3OCHCNC(CON)CH2C6H4F

Conditions
ConditionsYield
With sodium hydride In N,N-dimethyl-formamide at 20℃; for 12h;92%
13115-24-7

N-methylacetohydroxamic acid

456-42-8

m-fluorobenzyl chloride

1352918-96-7

N-((3-fluorobenzyl)oxy)-N-methylacetamide

Conditions
ConditionsYield
With sodium hydride In N,N-dimethyl-formamide; mineral oil at 0 - 20℃; for 12h; Inert atmosphere;92%
300-57-2

allylbenzene

456-42-8

m-fluorobenzyl chloride

1419174-93-8

1-(2-benzylallyl)-3-fluorobenzene

Conditions
ConditionsYield
With trimethylsilyl trifluoromethanesulfonate; trans-bis(dicyclohexylphenylphosphine)(2-methylphenyl)nickel(II) chloride; triethylamine In dichloromethane at 20℃; for 4h; Heck Reaction; regioselective reaction;92%
95-25-0

5-chloro-2-benzoxazolinone

456-42-8

m-fluorobenzyl chloride

5-chloro-3-(3-fluorobenzyl)benzo[d]oxazol-2(3H)-one

Conditions
ConditionsYield
Stage #1: 5-chloro-2-benzoxazolinone With potassium carbonate In N,N-dimethyl-formamide at 90℃; for 1h;
Stage #2: m-fluorobenzyl chloride In N,N-dimethyl-formamide at 60℃; for 7h;
92%
62-53-3

aniline

456-42-8

m-fluorobenzyl chloride

83444-26-2

N-(3-fluorobenzyl)aniline

Conditions
ConditionsYield
With sodium carbonate at 110℃; for 1h;90%
367-12-4

2-fluorophenol

456-42-8

m-fluorobenzyl chloride

C13H10F2O

Conditions
ConditionsYield
With sodium In ethanol for 2h; Heating;90%
1214839-99-2

(3R,6S)-hexahydrofuro[3,2-b]furan-3,6-diol

456-42-8

m-fluorobenzyl chloride

(3R,6S)-3,6-Bis-(3-fluoro-benzyloxy)-hexahydro-furo[3,2-b]furan

Conditions
ConditionsYield
With potassium hydroxide; tetrabutylammomium bromide In xylene at 125℃; for 0.0833333h; Alkylation; microwave irradiation;90%
107165-83-3

1-(4-chlorophenyl)-2-(tetrahydropyrimidin-2(1H)-ylidene)ethan-1-one

456-42-8

m-fluorobenzyl chloride

1-(4'-chloro-phenyl)-3-(3'-fluoro-phenyl)-2-(tetrahydropyrimidin-2'-ylidene)-propan-1-one

Conditions
ConditionsYield
In toluene at 65℃; for 3h;90%
456-42-8

m-fluorobenzyl chloride

5401-94-5

5-nitroindazole

A

529508-58-5

1-(3-fluorobenzyl)-5-nitro-1H-carbazole

B

202197-31-7

1-(3-fluorobenzyl)-1H-indazol-5-ylamine

Conditions
ConditionsYield
With Ki; potassium carbonate In water; N,N-dimethyl-formamideA 33%
B 90%
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    Name 3-Fluorobenzyl chloride Synonyms m-Fluorobenzyl chloride; alpha-Chloro-m-fluorotoluene; 1-(Chloromethyl)-3-fluoro-benzene CAS NO. 456-42-8 Molecular For

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Chemistry

Molecular Formula  m-Fluorobenzyl chloride(456-42-8) : C7H6ClF
Formula Weight m-Fluorobenzyl chloride(456-42-8) : 144.57
Molecular Structure:
Boiling point: 176-177 °C
density : 1.194 g/mL at 25 °C(lit.)
refractive index : n20/D 1.511(lit.)
Flash point : 138 °F
WATER Solubility of m-Fluorobenzyl chloride: 40 g/L (20 °C)

Uses

M-Fluorobenzyl chloride(456-42-8)  is For R&D use only. 

Toxicity Data With Reference

ACUTE EFFECTS:
Corrosive
May be harmful by ingestion and inhalation.
Material is irritating to mucous membranes and upper respiratory tract.
To the best of our knowledge, the toxicological properties of m-Fluorobenzyl chloride have not been fully determined.

Safety Profile

The Hazard Codes  of m-Fluorobenzyl chloride (456-42-8)  :  C
The Risk Statements information of  m-Fluorobenzyl chloride (456-42-8) :
34:  Causes burns 
37:  Irritating to the respiratory system 
The Safety Statements information of  m-Fluorobenzyl chloride(456-42-8) :
26:  In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 
45:  In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) 
36/37/39:  Wear suitable protective clothing, gloves and eye/face protection 
RIDADR : UN 2920 8/PG 2
WGK Germany : 3
Hazard Note : Corrosive/Lachrymatory
Hazard Class : 3
Packing Group : III