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| CAS No.: | 588702-62-9 |
|---|---|
| Name: | 4-(TRIFLUOROMETHYL)PYRIDINE-2-CARBOXYLIC ACID |
| Article Data: | 3 |
| Molecular Structure: | |
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| Formula: | C7H4F3NO2 |
| Molecular Weight: | 191.109 |
| Synonyms: | 4-Trifluoromethyl-2-picolinic acid; |
| EINECS: | 633-443-9 |
| Density: | 1.485 g/cm3 |
| Melting Point: | 159-161 °C |
| Boiling Point: | 293.604 °C at 760 mmHg |
| Flash Point: | 131.367 °C |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26-36/37/39 |
| PSA: | 50.19000 |
| LogP: | 1.79860 |
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Specification
The cas register number of 4-(Trifluoromethyl)pyridine-2-carboxylic acid is 588702-62-9. It also can be called as 2-Pyridinecarboxylicacid, 4-(trifluoromethyl)- and the Systematic name about this chemical is 4-(trifluoromethyl)pyridine-2-carboxylic acid. It belongs to the following product categories, such as Pyridine series, Carboxylic Acids, Pyridines, Carboxylic Acids and so on.
Physical properties about 4-(Trifluoromethyl)pyridine-2-carboxylic acid are: (1)ACD/LogP: 0.96; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 50.19Å2; (10)Index of Refraction: 1.475; (11)Molar Refractivity: 36.25 cm3; (12)Molar Volume: 128.6 cm3; (13)Polarizability: 14.37x10-24cm3; (14)Surface Tension: 38.5 dyne/cm; (15)Enthalpy of Vaporization: 56.31 kJ/mol; (16)Boiling Point: 293.6 °C at 760 mmHg; (17)Vapour Pressure: 0.000777 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1cc(ccn1)C(F)(F)F
(2)InChI: InChI=1/C7H4F3NO2/c8-7(9,10)4-1-2-11-5(3-4)6(12)13/h1-3H,(H,12,13)
(3)InChIKey: BPRWTROIQXSSOC-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C7H4F3NO2/c8-7(9,10)4-1-2-11-5(3-4)6(12)13/h1-3H,(H,12,13)
(5)Std. InChIKey: BPRWTROIQXSSOC-UHFFFAOYSA-N