2-Fluoro-6-nitrophenol supplier

Name
2-Fluoro-6-nitrophenol
EINECS 216-199-4
CAS No. 1526-17-6
Article Data11
CAS DataBase
Density 1.511 g/cm³
Solubility
Melting Point 92-94 ºC
Formula C₆H₄FNO₃
Boiling Point 201.5 ºC at 760 mmHg
Molecular Weight 157.101
Flash Point 75.6 ºC
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 22-36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 6-Fluoro-2-nitrophenol;NSC 10282;
PSA 66.05000
LogP 1.96270

Synthetic route

: 367-12-4
2-fluorophenol

: 1526-17-6
2-fluoro-6-nitrophenol

Conditions

Conditions	Yield
With trichloroisocyanuric acid; bismuth subnitrate/charcoal In dichloromethane at 20℃; for 1h; regioselective reaction;	85%
With nitric acid In dichloromethane at 0℃; for 1h;
With nitric acid In dichloromethane at 0 - 5℃; for 1h;
With nitric acid In dichloromethane at 0℃; for 1h;

: 402-67-5
3-fluoro-1-nitrobenzene

A: 1526-17-6
2-fluoro-6-nitrophenol

B: 403-19-0
2-fluoro-4-nitrophenol

Conditions

Conditions	Yield
With tert.-butylhydroperoxide; potassium tert-butylate; ammonia In tetrahydrofuran for 0.25h;	A 7% B 76%

: 367-12-4
2-fluorophenol

A: 1526-17-6
2-fluoro-6-nitrophenol

B: 403-19-0
2-fluoro-4-nitrophenol

Conditions

Conditions	Yield
With Nitrogen dioxide In pentane 35 min, 0 deg C then 20 min, room temperature;	A 47% B 49%

: 367-12-4
2-fluorophenol

A: 1526-17-6
2-fluoro-6-nitrophenol

B: 681227-38-3
fluoro-[1,4]benzoquinone-4-oxime

Conditions

Conditions	Yield
With hydrogenchloride; sodium nitrite at 0℃;

: 367-12-4
2-fluorophenol

A: 1526-17-6
2-fluoro-6-nitrophenol

B: 351-49-5
2-fluoro-4-nitroso-phenol

Conditions

Conditions	Yield
With hydrogenchloride; sodium nitrite at 0℃;

: 367-12-4
2-fluorophenol

A: 1526-17-6
2-fluoro-6-nitrophenol

B: 403-19-0
2-fluoro-4-nitrophenol

C: 123871-61-4
6-fluoro-6-nitrocyclohexa-2,4-dienone

Conditions

Conditions	Yield
With nitric acid In acetic anhydride at -60℃; Title compound not separated from byproducts;
With nitric acid In acetic anhydride Title compound not separated from byproducts;

...Expand

5-fluoro-3-nitro-4-methoxy-benzene-sulfonic acid-(1): 5-fluoro-3-nitro-4-methoxy-benzene-sulfonic acid-(1)

: 1526-17-6
2-fluoro-6-nitrophenol

Conditions

Conditions	Yield
With steam at 170 - 190℃;

: 367-12-4
2-fluorophenol

: 7440-44-0
pyrographite

A: 1526-17-6
2-fluoro-6-nitrophenol

B: 403-19-0
2-fluoro-4-nitrophenol

Conditions

Conditions	Yield
With nitric acid In hexane; dichloromethane	A 13.5 g (30 %) B n/a
With nitric acid In hexane; dichloromethane	A 13.5 g (30 %) B n/a

...Expand

: 1526-17-6
2-fluoro-6-nitrophenol

: 105-36-2
ethyl bromoacetate

: ethyl2-(2-fluoro-6-nitrophenoxy)acetate

Conditions

Conditions	Yield
Stage #1: 2-fluoro-6-nitrophenol With potassium hydroxide In ethanol for 1h; Stage #2: ethyl bromoacetate In N,N-dimethyl-formamide for 24h; Further stages.;	99%
With potassium carbonate In acetonitrile at 90℃; for 2h;	74.7%

: 358-23-6
trifluoromethylsulfonic anhydride

: 1526-17-6
2-fluoro-6-nitrophenol

: 122455-35-0
2-fluoro-6-nitrophenyl trifluoromethanesulfonate

Conditions

Conditions	Yield
With potassium carbonate	98%
With potassium carbonate In acetone at 20℃; for 4h;	40%
Stage #1: 2-fluoro-6-nitrophenol With potassium carbonate In acetone at 20℃; for 0.333333h; Stage #2: trifluoromethylsulfonic anhydride In acetone at 20℃; for 4h;	40%
With pyridine In dichloromethane at 0℃; for 2h;

: 1526-17-6
2-fluoro-6-nitrophenol

: 96-32-2
bromoacetic acid methyl ester

: 698984-51-9
(2-fluoro-6-nitrophenoxy)acetic acid, methyl ester

Conditions

Conditions	Yield
With potassium carbonate In acetone at 65℃; for 3h;	98%
With potassium carbonate In acetone for 5h; Reflux;	93%

: 1526-17-6
2-fluoro-6-nitrophenol

: 598-72-1
2-Bromopropionic acid

: 698984-51-9
(2-fluoro-6-nitrophenoxy)acetic acid, methyl ester

Conditions

Conditions	Yield
With potassium carbonate In acetone for 5h; Heating / reflux;	93%

: 1526-17-6
2-fluoro-6-nitrophenol

: 53981-25-2
2-amino-6-fluoro phenol

Conditions

Conditions	Yield
With palladium 10% on activated carbon; hydrogen In methanol for 1h;	87%
With tin(ll) chloride In tetrahydrofuran; water Reflux;	55.3%
Stage #1: 2-fluoro-6-nitrophenol With water; tin(ll) chloride In tetrahydrofuran at 80℃; for 2h; Stage #2: With sodium hydrogencarbonate In water	12%
With ammonium formate; palladium 10% on activated carbon In methanol at 20℃; for 0.5h;
With hydrogen; nickel In methanol under 760.051 Torr;

: 687-47-8
(S)-Ethyl lactate

: 1526-17-6
2-fluoro-6-nitrophenol

: ethyl (2R)-2-(2-fluoro-6-nitrophenoxy)propanoate

Conditions

Conditions	Yield
With di-isopropyl azodicarboxylate; triphenylphosphine In dichloromethane at 0 - 20℃; for 1.5h;	83%

: 1526-17-6
2-fluoro-6-nitrophenol

: 106-95-6
allyl bromide

: 2-fluoro-6-nitrophenyl prop-2-en-1-yl ether

Conditions

Conditions	Yield
With potassium carbonate; calcium carbonate In N,N-dimethyl-formamide at 100℃; for 6h;	83%
With potassium carbonate In N,N-dimethyl-formamide at 100℃; for 6h;	83%

: 453-20-3
3-Hydroxytetrahydrofuran

: 1526-17-6
2-fluoro-6-nitrophenol

: 917909-41-2
3-(2-fluoro-6-nitrophenoxy)-tetrahydrofuran

Conditions

Conditions	Yield
With triphenylphosphine; diethylazodicarboxylate In dichloromethane at 20℃; for 20h;	68%

: 1526-17-6
2-fluoro-6-nitrophenol

: C10H9NO2

A: C16H11FN2O4

B: C16H11FN2O4

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	A 58% B n/a

...Expand

: 1526-17-6
2-fluoro-6-nitrophenol

: C13H17NO2

A: C19H19FN2O4

B: C19H19FN2O4

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	A 54% B n/a

...Expand

: 1526-17-6
2-fluoro-6-nitrophenol

: C9H6BrNO2

A: C15H8BrFN2O4

B: C15H8BrFN2O4

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	A 50% B n/a

...Expand

: 1526-17-6
2-fluoro-6-nitrophenol

: C13H9NO2

: C19H11FN2O4

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	49%

: 1526-17-6
2-fluoro-6-nitrophenol

: C9H7NO2

: C15H9FN2O4

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	46%

: 1526-17-6
2-fluoro-6-nitrophenol

: C9H6ClNO2

A: C15H8ClFN2O4

B: C15H8ClFN2O4

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	A n/a B 46%

...Expand

: 1526-17-6
2-fluoro-6-nitrophenol

: C15H11NO2

: C21H13FN2O4

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	43%

: 1526-17-6
2-fluoro-6-nitrophenol

: C7H5NO3

A: C13H7FN2O5

B: C13H7FN2O5

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	A 43% B n/a

...Expand

: 1526-17-6
2-fluoro-6-nitrophenol

: C7H5NO2S

A: C13H7FN2O4S

B: C13H7FN2O4S

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	A 42% B n/a

...Expand

: 1526-17-6
2-fluoro-6-nitrophenol

: C11H7NO2S

: C17H9FN2O4S

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	41%

: 1526-17-6
2-fluoro-6-nitrophenol

: C10H6F3NO2

: C16H8F4N2O4

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	39%

: 1526-17-6
2-fluoro-6-nitrophenol

: C9H6ClNO2

: C15H8ClFN2O4

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	39%

: 1526-17-6
2-fluoro-6-nitrophenol

: C9H6(2)HNO2

: C15H8(2)HFN2O4

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	39%

: 1526-17-6
2-fluoro-6-nitrophenol

: C9H6BrNO2

: C15H8BrFN2O4

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	38%

: 1526-17-6
2-fluoro-6-nitrophenol

: C11H9NO2

A: C17H11FN2O4

B: C17H11FN2O4

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	A 37% B n/a

...Expand

: 1526-17-6
2-fluoro-6-nitrophenol

: C11H7NO3

: C17H9FN2O5

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	35%

: 1526-17-6
2-fluoro-6-nitrophenol

: 59524-02-6
N-tert-butoxycarbonyl-L-serine benzyl ester

: (S)-2-(tert-butoxycarbonylamino)-3-(2-fluoro-6-nitrophenoxy)propanoic acid

Conditions

Conditions	Yield
Stage #1: 2-fluoro-6-nitrophenol With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran at -3℃; for 0.166667h; Stage #2: N-tert-butoxycarbonyl-L-serine benzyl ester at 20℃; for 16h;	30%

: 1526-17-6
2-fluoro-6-nitrophenol

: C7H11NO2

: C13H13FN2O4

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In ethyl acetate at 25℃; for 0.12h; Schlenk technique;	18%

2-Fluoro-6-nitrophenol Specification

The 2-Fluoro-6-nitrophenol, with the CAS registry number 1526-17-6, is also known as Phenol, 2-fluoro-6-nitro-. It belongs to the product category of Fluorobenzene. Its EINECS registry number is 216-199-4. This chemical's molecular formula is C₆H₄FNO₃ and molecular weight is 157.10. What's more, its IUPAC name is the same with its product name. It should be kept in a cold and dry place.

Physical properties about 2-Fluoro-6-nitrophenol are: (1)ACD/LogP: 1.84; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.61; (4)ACD/LogD (pH 7.4): 0.12; (5)ACD/BCF (pH 5.5): 8.77; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 142.25; (8)ACD/KOC (pH 7.4): 4.53; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 55.05 Å²; (13)Index of Refraction: 1.581; (14)Molar Refractivity: 34.67 cm³; (15)Molar Volume: 103.9 cm³; (16)Surface Tension: 56.4 dyne/cm; (17)Density: 1.511 g/cm³; (18)Flash Point: 75.6 °C; (19)Enthalpy of Vaporization: 45.56 kJ/mol; (20)Boiling Point: 201.5 °C at 760 mmHg; (21)Vapour Pressure: 0.217 mmHg at 25 °C.

Preparation of 2-Fluoro-6-nitrophenol: this chemical can be prepared by 1-Fluoro-3-nitro-benzene. This reaction needs reagents t-BuOK, t-BuOOH, NH₃ and solvent tetrahydrofuran. The reaction time is 15 min. The yield is 76 %.

2-Fluoro-6-nitrophenol can be prepared by 1-Fluoro-3-nitro-benzene.

When you are dealing with this chemical, you should be very careful. This chemical is inflammation to the skin, eyes and respiratory system or other mucous membranes. If swallowed, it's harmful to health. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. And in case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc1cccc([N+]([O-])=O)c1O
(2) InChI: InChI=1S/C6H4FNO3/c7-4-2-1-3-5(6(4)9)8(10)11/h1-3,9H
(3) InChIKey: HIGRXCJEFUYRNW-UHFFFAOYSA-N

Product Name

2-Fluoro-6-nitrophenol

Synthetic route

2-Fluoro-6-nitrophenol Specification

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