Name: 3-FLUORO-2-IODOTOLUENE
SKU: 883502-14-5

Products Categories

Pharmaceutical (39)
Organic Chemicals (11)
Others (6)
Reagent (3)

Basic Information

Molecular Structure:
CAS No.:	883502-14-5
Name:	3-FLUORO-2-IODOTOLUENE
Article Data:	23

Formula:	C₇H₆FI
Molecular Weight:	236.028
Synonyms:	1-Fluoro-2-iodo-3-methylbenzene;2-Iodo-3-fluorotoluene
Density:	1.788 g/cm³
Boiling Point:	212 °C at 760 mmHg
Flash Point:	85.2 °C
PSA:	0.00000
LogP:	2.73870

Synthetic route

: 443-89-0
2-fluoro-6-methylaniline

: 883502-14-5
1-fluoro-2-iodo-3-methylbenzene

Conditions

Conditions	Yield
Stage #1: 2-fluoro-6-methylaniline With hydrogenchloride In water at 0℃; for 0.25h; Stage #2: With sodium nitrite In water at 0℃; for 1.67h; Stage #3: With potassium iodide In water at 0℃; for 2.17h;	73%

: 288-13-1
NH-pyrazole

: 883502-14-5
1-fluoro-2-iodo-3-methylbenzene

: 1-(2-iodo-3-methylphenyl)-1H-pyrazole

Conditions

Conditions	Yield
With potassium phosphate In N,N-dimethyl-formamide at 150℃; for 2h; Microwave irradiation; Inert atmosphere; Schlenk technique;	70%

: 271-44-3
benzimidazole

: 883502-14-5
1-fluoro-2-iodo-3-methylbenzene

: 1-(2-iodo-3-methylphenyl)-1H-indazole

Conditions

Conditions	Yield
With potassium phosphate In N,N-dimethyl-formamide at 150℃; for 2h; Microwave irradiation; Inert atmosphere; Schlenk technique;	48%

: 288-88-0
1,2,4-Triazole

: 883502-14-5
1-fluoro-2-iodo-3-methylbenzene

: 1-(2-iodo-3-methylphenyl)-1H-1,2,4-triazole

Conditions

Conditions	Yield
With potassium phosphate In N,N-dimethyl-formamide at 150℃; for 6h; Microwave irradiation; Inert atmosphere; Schlenk technique;	31%

: 95-14-7
1,2,3-Benzotriazole

: 883502-14-5
1-fluoro-2-iodo-3-methylbenzene

: 1-(2-iodo-3-methylphenyl)-1H-benzo[d][1,2,3]triazole

Conditions

Conditions	Yield
With caesium carbonate In N,N-dimethyl-formamide at 150℃; for 5h; Sealed tube; Inert atmosphere; Schlenk technique;	19%

: 557-21-1
zinc(II) cyanide

: 883502-14-5
1-fluoro-2-iodo-3-methylbenzene

: 198633-76-0
2-fluoro-6-methyl-benzonitrile

Conditions

Conditions	Yield
With tetrakis(triphenylphosphine) palladium(0) In N,N-dimethyl acetamide at 80℃; for 16h; Inert atmosphere;
With tetrakis(triphenylphosphine) palladium(0) In N,N-dimethyl acetamide at 80℃; for 16h; Inert atmosphere;
With tetrakis(triphenylphosphine) palladium(0) In dimethyl amine at 80℃; Inert atmosphere;

: 883502-14-5
1-fluoro-2-iodo-3-methylbenzene

: 1255207-47-6
3-bromo-6-fluoro-2-methyl-benzonitrile

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: tetrakis(triphenylphosphine) palladium(0) / N,N-dimethyl acetamide / 16 h / 80 °C / Inert atmosphere 2: trifluorormethanesulfonic acid; N-Bromosuccinimide / 1 h / 0 - 20 °C View Scheme
Multi-step reaction with 2 steps 1: tetrakis(triphenylphosphine) palladium(0) / dimethyl amine / 80 °C / Inert atmosphere 2: N-Bromosuccinimide / trifluorormethanesulfonic acid / 1 h / 20 °C View Scheme
Multi-step reaction with 2 steps 1: tetrakis(triphenylphosphine) palladium(0) / N,N-dimethyl acetamide / 16 h / 80 °C / Inert atmosphere 2: N-Bromosuccinimide / trifluorormethanesulfonic acid / 1 h / 0 - 20 °C View Scheme

: 883502-14-5
1-fluoro-2-iodo-3-methylbenzene

: 1255207-48-7
3-ethenyl-6-fluoro-2-methylbenzonitrile

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: tetrakis(triphenylphosphine) palladium(0) / N,N-dimethyl acetamide / 16 h / 80 °C / Inert atmosphere 2: trifluorormethanesulfonic acid; N-Bromosuccinimide / 1 h / 0 - 20 °C 3: dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH2Cl2; triethylamine / ethanol / 4 h / Inert atmosphere; Reflux View Scheme
Multi-step reaction with 3 steps 1: tetrakis(triphenylphosphine) palladium(0) / dimethyl amine / 80 °C / Inert atmosphere 2: N-Bromosuccinimide / trifluorormethanesulfonic acid / 1 h / 20 °C 3: triethylamine; dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH2Cl2 / ethanol / 4 h / Reflux View Scheme
Multi-step reaction with 3 steps 1: tetrakis(triphenylphosphine) palladium(0) / N,N-dimethyl acetamide / 16 h / 80 °C / Inert atmosphere 2: N-Bromosuccinimide / trifluorormethanesulfonic acid / 1 h / 0 - 20 °C 3: dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH2Cl2; triethylamine / ethanol / 4 h / Reflux View Scheme

: 883502-14-5
1-fluoro-2-iodo-3-methylbenzene

: 1255207-46-5
6-fluoro-2-methyl-3-(oxiran-2-yl)benzonitrile

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1: tetrakis(triphenylphosphine) palladium(0) / N,N-dimethyl acetamide / 16 h / 80 °C / Inert atmosphere 2: trifluorormethanesulfonic acid; N-Bromosuccinimide / 1 h / 0 - 20 °C 3: dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH2Cl2; triethylamine / ethanol / 4 h / Inert atmosphere; Reflux 4: 3-chloro-benzenecarboperoxoic acid / dichloromethane / 72 h / 0 - 20 °C View Scheme
Multi-step reaction with 4 steps 1: tetrakis(triphenylphosphine) palladium(0) / dimethyl amine / 80 °C / Inert atmosphere 2: N-Bromosuccinimide / trifluorormethanesulfonic acid / 1 h / 20 °C 3: triethylamine; dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH2Cl2 / ethanol / 4 h / Reflux 4: 3-chloro-benzenecarboperoxoic acid / dichloromethane / 72 h / 20 °C View Scheme
Multi-step reaction with 4 steps 1: tetrakis(triphenylphosphine) palladium(0) / N,N-dimethyl acetamide / 16 h / 80 °C / Inert atmosphere 2: N-Bromosuccinimide / trifluorormethanesulfonic acid / 1 h / 0 - 20 °C 3: dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH2Cl2; triethylamine / ethanol / 4 h / Reflux 4: 3-chloro-benzenecarboperoxoic acid / dichloromethane / 72 h / 0 - 20 °C View Scheme

: 883502-14-5
1-fluoro-2-iodo-3-methylbenzene

: 1426071-25-1
tert-butyl (3S)-4-[2-(3-cyano-4-fluoro-2-methylphenyl)-2-hydroxyethyl]-3-(hydroxymethyl)piperazine-1-carboxylate

Conditions

Conditions	Yield
Multi-step reaction with 5 steps 1: tetrakis(triphenylphosphine) palladium(0) / N,N-dimethyl acetamide / 16 h / 80 °C / Inert atmosphere 2: trifluorormethanesulfonic acid; N-Bromosuccinimide / 1 h / 0 - 20 °C 3: dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH2Cl2; triethylamine / ethanol / 4 h / Inert atmosphere; Reflux 4: 3-chloro-benzenecarboperoxoic acid / dichloromethane / 72 h / 0 - 20 °C 5: ethanol / 0.5 h / 150 °C / Microwave irradiation View Scheme
Multi-step reaction with 5 steps 1: tetrakis(triphenylphosphine) palladium(0) / dimethyl amine / 80 °C / Inert atmosphere 2: N-Bromosuccinimide / trifluorormethanesulfonic acid / 1 h / 20 °C 3: triethylamine; dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH2Cl2 / ethanol / 4 h / Reflux 4: 3-chloro-benzenecarboperoxoic acid / dichloromethane / 72 h / 20 °C 5: ethanol / 0.5 h / 150 °C / Microwave irradiation View Scheme
Multi-step reaction with 5 steps 1: tetrakis(triphenylphosphine) palladium(0) / N,N-dimethyl acetamide / 16 h / 80 °C / Inert atmosphere 2: N-Bromosuccinimide / trifluorormethanesulfonic acid / 1 h / 0 - 20 °C 3: dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH2Cl2; triethylamine / ethanol / 4 h / Reflux 4: 3-chloro-benzenecarboperoxoic acid / dichloromethane / 72 h / 0 - 20 °C 5: ethanol / 0.5 h / 150 °C / Microwave irradiation View Scheme

Country:
Business Type:
All

Lab/Research institutions

Trading Company

Manufacturers

Other
Certificate:
Manufacturer

Enterprise Authentication

ISO

GMP

FDA

HALAL

Display:default sort
Suppiers of more reward points first

New supplier

Total:48 Page 1 of 2 1 2 Next>>

Post a RFQ

Cas No.:

Product Name:

Quantity:

Email:

Company name:

Valid Period:

Detailed Requirements:

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

What can I do for you?
Get Best Price

Get Best Price for 883502-14-5

Specification

This chemical is called Benzene, 1-fluoro-2-iodo-3-methyl-, and its systematic name is 1-Fluoro-2-iodo-3-methylbenzene. With the molecular formula of C₇H₆FI, its molecular weight is 236.03. The CAS registry number of this chemical is 883502-14-5.

Other characteristics of the Benzene, 1-fluoro-2-iodo-3-methyl- can be summarised as followings: (1)ACD/LogP: 3.68; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 0; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 0 Å²; (7)Index of Refraction: 1.58; (8)Molar Refractivity: 43.97 cm³; (9)Molar Volume: 131.9 cm³; (10)Polarizability: 17.43×10^-24cm³; (11)Surface Tension: 37.9 dyne/cm; (12)Density: 1.788 g/cm³; (13)Flash Point: 85.2 °C; (14)Enthalpy of Vaporization: 43 kJ/mol; (15)Boiling Point: 212 °C at 760 mmHg; (16)Vapour Pressure: 0.258 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Fc1cccc(c1I)C
2.InChI: InChI=1/C7H6FI/c1-5-3-2-4-6(8)7(5)9/h2-4H,1H3
3.InChIKey: WXHRYDHCFKJKKO-UHFFFAOYAG