| Identification | More | [Name]
4-Cyano-3-fluorobenzoic acid | [CAS]
176508-81-9 | [Synonyms]
3-FLUORO-4-CYANOBENZOIC ACID
4-CYANO-3-FLUOROBENZOIC ACID
3-FLUORO-4-CYANOBENZOIC ACID,98+% | [Molecular Formula]
C8H4FNO2 | [MDL Number]
MFCD03094324 | [Molecular Weight]
165.12 | [MOL File]
176508-81-9.mol |
| Chemical Properties | Back Directory | [Melting point ]
162.0 to 166.0 °C | [Boiling point ]
335.7±27.0 °C(Predicted) | [density ]
1.42±0.1 g/cm3(Predicted) | [storage temp. ]
Sealed in dry,Room Temperature | [solubility ]
soluble in Methanol | [form ]
powder to crystal | [pka]
3.20±0.10(Predicted) | [color ]
White to Almost white | [InChI]
1S/C8H4FNO2/c9-7-3-5(8(11)12)1-2-6(7)4-10/h1-3H,(H,11,12) | [InChIKey]
ZWKNDLMYSLLMRF-UHFFFAOYSA-N | [SMILES]
OC(=O)c1ccc(C#N)c(F)c1 | [CAS DataBase Reference]
176508-81-9(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi,Xn | [Risk Statements ]
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R41:Risk of serious damage to eyes.
R37/38:Irritating to respiratory system and skin .
R22:Harmful if swallowed. | [Safety Statements ]
S22:Do not breathe dust .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S39:Wear eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice . | [RIDADR ]
3439 | [WGK Germany ]
3 | [Hazard Note ]
Irritant | [HS Code ]
29269090 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Acute Tox. 4 Oral
Eye Dam. 1
Skin Irrit. 2
STOT SE 3 |
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