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| CAS No.: | 446-36-6 |
|---|---|
| Name: | 5-Fluoro-2-nitrophenol |
| Article Data: | 16 |
| Molecular Structure: | |
|
|
|
| Formula: | C6H4FNO3 |
| Molecular Weight: | 157.101 |
| Synonyms: | 2-Nitro-5-fluorophenol;3-Fluoro-6-nitrophenol;4-Fluoro-2-hydroxy-1-nitrobenzene;4-Fluoro-2-hydroxynitrobenzene;NSC 10284; |
| EINECS: | 207-168-6 |
| Density: | 1.511 g/cm3 |
| Melting Point: | 34-37 °C(lit.) |
| Boiling Point: | 228.5 °C at 760 mmHg |
| Flash Point: | 91.7 °C |
| Solubility: | slightly soluble in water |
| Appearance: | white to light yellow crystal powder |
| Hazard Symbols: |
 Xn,  Xi
|
| Risk Codes: | 20/21/22-36/37/38 |
| Safety: | 26-36/37-36/37/39 |
| PSA: | 66.05000 |
| LogP: | 1.96270 |
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Chemistry
Molecular Structure of Phenol,5-fluoro-2-nitro- (CAS No. 446-36-6):
IUPAC Name: 5-Fluoro-2-nitrophenol
Molecular Formula: C6H4FNO3
Molecular Weight: 157.099263 g/mol
Appearance: white to light yellow crystal powder
Index of Refraction: 1.581
Molar Refractivity: 34.67 cm3
Molar Volume: 103.9 cm3
Surface Tension: 56.4 dyne/cm
Density: 1.511 g/cm3
Flash Point: 91.7 °C
Enthalpy of Vaporization: 48.4 kJ/mol
Boiling Point: 228.5 °C at 760 mmHg
Vapour Pressure: 0.0486 mmHg at 25°C
Melting Point: 34-37 °C(lit.)
BRN: 1870311
EINECS: 207-168-6
Product Categories: blocks;FluoroCompounds;NitroCompounds;Aromatic Phenols;Benzene series;Phenol&Thiophenol&Mercaptan;Fluorobenzene;Organic Building Blocks;Oxygen Compounds;Phenols;Alphabetic;F;FA - FLOrganic Building Blocks
Structure Descriptors of Phenol,5-fluoro-2-nitro- (CAS No. 446-36-6):
SMILES: O=[N+]([O-])c1ccc(F)cc1O
InChI: InChI=1/C6H4FNO3/c7-4-1-2-5(8(10)11)6(9)3-4/h1-3,9H
InChIKey: QQURWFRNETXFTN-UHFFFAOYAE
Std. InChI: InChI=1S/C6H4FNO3/c7-4-1-2-5(8(10)11)6(9)3-4/h1-3,9H
Std. InChIKey: QQURWFRNETXFTN-UHFFFAOYSA-N
Safety Profile
Safety Information of Phenol,5-fluoro-2-nitro- (CAS No. 446-36-6):
Hazard Codes: Xn,Xi 
HazardClass: IRRITANT
Risk Statements: 20/21/22-36/37/38
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36/37-36/37/39-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
S36:Wear suitable protective clothing.
WGK Germany: 3
Hazard Note: Harmful
HS Code: 29089000
Specification
Phenol,5-fluoro-2-nitro- with cas registry number of 446-36-6 is also called NSC 10284 ; 5-Fluoro-2-nitrophenol .