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4-Chloro-6-methyl-2-(trifluoromethyl)quinoline

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Name

4-Chloro-6-methyl-2-(trifluoromethyl)quinoline

EINECS N/A
CAS No. 1701-26-4 Density 1.376 g/cm3
PSA 12.89000 LogP 4.21540
Solubility N/A Melting Point 62-65 °C
Formula C11H7ClF3N Boiling Point 258.417 °C at 760 mmHg
Molecular Weight 245.631 Flash Point 110.087 °C
Transport Information N/A Appearance N/A
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 1701-26-4 (4-CHLORO-6-METHYL-2-(TRIFLUOROMETHYL)QUINOLINE) Hazard Symbols IrritantXi
Synonyms

NSC 128775;

Article Data 3

4-Chloro-6-methyl-2-(trifluoromethyl)quinoline Specification

The 4-Chloro-6-methyl-2-(trifluoromethyl)quinoline, its cas register number is 1701-26-4. It also can be called as Quinoline,4-chloro-6-methyl-2-(trifluoromethyl)- and the IUPAC name about this chemical is 4-Chloro-6-methyl-2-(trifluoromethyl)quinoline. It belongs to the Quinoline&Isoquinoline.

Physical properties about 4-Chloro-6-methyl-2-(trifluoromethyl)quinoline are: (1)ACD/LogP: 4.35; (2)ACD/LogD (pH 5.5): 4.35; (3)ACD/LogD (pH 7.4): 4.35; (4)ACD/BCF (pH 5.5): 1178.56; (5)ACD/BCF (pH 7.4): 1189.48; (6)ACD/KOC (pH 5.5): 5481.73; (7)ACD/KOC (pH 7.4): 5532.56; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 48.14Å2; (12)Index of Refraction: 1.645; (13)Molar Refractivity: 67.43 cm3; (14)Molar Volume: 185.8 cm3; (15)Polarizability: 26.73x10-24cm3; (16)Surface Tension: 55.2 dyne/cm; (17)Enthalpy of Vaporization: 62.44 kJ/mol; (18)Vapour Pressure: 7.11E-06 mmHg at 25°C

When you are using this chemical, you should be very cautious. Being a kind of irritant chemical, it is irritating to eyes, respiratory system and skin. When you are contacting with it, wear suitable protective clothing. And if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC2=C(C=C1)N=C(C=C2Cl)C(F)(F)F
(2)InChI: InChI=1S/C11H7ClF3N/c1-6-2-3-9-7(4-6)8(12)5-10(16-9)11(13,14)15/h2-5H,1H3 
(3)InChIKey: ZLSXNETUGWRDSH-UHFFFAOYSA-N

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