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CAS No.: | 89570-83-2 |
---|---|
Name: | 3-(Trifluoromethyl)pyrid-2-ylhydrazine |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C6H6F3N3 |
Molecular Weight: | 177.129 |
Synonyms: | 2(1H)-Pyridinone,3-(trifluoromethyl)-, hydrazone (9CI);2-Hydrazino-3-(trifluoromethyl)pyridine; |
EINECS: | 670-805-5 |
Density: | 1.442g/cm3 |
Boiling Point: | 250.1 °C at 760 mmHg |
Flash Point: | 105 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36/37/39 |
PSA: | 50.94000 |
LogP: | 2.15930 |
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The 3-(Trifluoromethyl)pyrid-2-ylhydrazine, with CAS registry number 89570-83-2, belongs to the following product category: Pyridines. It has the systematic name of 2-hydrazino-3-(trifluoromethyl)pyridine. Its molecular weight is 177.13. And the chemical formula of this chemical is C6H6F3N3.
Physical properties of 3-(Trifluoromethyl)pyrid-2-ylhydrazine: (1)ACD/LogP: 0.95; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.92; (4)ACD/LogD (pH 7.4): 0.95; (5)ACD/BCF (pH 5.5): 2.92; (6)ACD/BCF (pH 7.4): 3.1; (7)ACD/KOC (pH 5.5): 73.64; (8)ACD/KOC (pH 7.4): 78.2; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 19.37 Å2; (13)Index of Refraction: 1.528; (14)Molar Refractivity: 37.83 cm3; (15)Molar Volume: 122.7 cm3; (16)Polarizability: 14.99×10-24cm3; (17)Surface Tension: 38.9 dyne/cm; (18)Density: 1.442 g/cm3; (19)Flash Point: 105 °C; (20)Enthalpy of Vaporization: 48.73 kJ/mol; (21)Boiling Point: 250.1 °C at 760 mmHg; (22)Vapour Pressure: 0.0221 mmHg at 25°C.
Preparation: this chemical can be prepared by 2-chloro-3-trifluoromethylpyridine. This reaction will need reagent NH2NH2.H2O and solvent ethanol. The reaction time is 3 hour(s).
Uses of 3-(Trifluoromethyl)pyrid-2-ylhydrazine: it can be used to produce 8-trifluoromethyl-tetrazolo[1,5-a]pyridine. This reaction will need reagent NaNO2, aq. HCl. The yield is about 85%.
When you are using this chemical, please be cautious about it as the following:
The 3-(Trifluoromethyl)pyrid-2-ylhydrazine irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If 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: FC(F)(F)c1cccnc1NN
(2)InChI: InChI=1/C6H6F3N3/c7-6(8,9)4-2-1-3-11-5(4)12-10/h1-3H,10H2,(H,11,12)
(3)InChIKey: TWPMJXZSKBAITM-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C6H6F3N3/c7-6(8,9)4-2-1-3-11-5(4)12-10/h1-3H,10H2,(H,11,12)
(5)Std. InChIKey: TWPMJXZSKBAITM-UHFFFAOYSA-N