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CAS No.: | 164149-28-4 |
---|---|
Name: | 4-CYANO-2-FLUOROBENZOIC ACID |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C8H4FNO2 |
Molecular Weight: | 165.124 |
Synonyms: | 2-Fluoro-4-cyanobenzoicacid; |
EINECS: | -0 |
Density: | 1.42 g/cm3 |
Melting Point: | 214-216 °C |
Boiling Point: | 326.3 °C at 760 mmHg |
Flash Point: | 151.1 °C |
Solubility: | Insoluble in water. |
Hazard Symbols: | Xn, T, Xi |
Risk Codes: | 22-36/37/38-41 |
Safety: | 26-36/37/39-39 |
Transport Information: | UN 3439 |
PSA: | 61.09000 |
LogP: | 1.39558 |
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Systematic Name: 4-Cyano-2-fluorobenzoic acid
Empirical Formula: C8H4FNO2
Molecular Weight: 165.1213
Nominal Mass: 165
Average Mass: 165.1213
Monoisotopic Mass: 165.022607
SMILES: O=C(O)c1ccc(C#N)cc1F
InChI: InChI=1/C8H4FNO2/c9-7-3-5(4-10)1-2-6(7)8(11)12/h1-3H,(H,11,12)
InChIKey: KEJMSTJTAWACNI-UHFFFAOYAK
Index of Refraction: 1.564
Molar Refractivity: 37.7 cm3
Molar Volume: 115.8 cm3
Surface Tension: 58.8 dyne/cm
Density: 1.42 g/cm3
Flash Point: 151.1 °C
Enthalpy of Vaporization: 60.01 kJ/mol
Boiling Point: 326.3 °C at 760 mmHg
Vapour Pressure: 8.87E-05 mmHg at 25 °C
Product Categories: Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts; C8Nitrogen Compounds; C8 to C9Chemical Synthesis; Carbonyl Compounds; Carboxylic Acids; Cyanides/Nitriles; New Products for Chemical Synthesis; Organic Building Blocks
Melting Point of 4-Cyano-2-fluorobenzoic acid (CAS NO.164149-28-4): 214-216 °C
Hazard Codes: Xi,T,Xn
Risk Statements: 22-36/37/38-41
R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin.
R41:Risk of serious damage to the eyes.
Safety Statements: 26-36/37/39-39
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.
S39:Wear eye / face protection.
RIDADR: 3439
Hazard Note: Irritant
HazardClass: 6.1
PackingGroup of 4-Cyano-2-fluorobenzoic acid (CAS NO.164149-28-4): III
4-Cyano-2-fluorobenzoic acid (CAS NO.164149-28-4), its Synonyms are 2-Fluoro-4-cyanobenzoic acid ; 4-Amino-2,3-difluorophenol ; Benzoic acid, 4-cyano-2-fluoro- .