CAS No.188817-13-2,SC-560 Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	188817-13-2
Name:	SC-560
Article Data:	6

Formula:	C₁₇H₁₂ClF₃N₂O
Molecular Weight:	352.743
Synonyms:	SC 560;5-(4-Chlorophenyl)-1-(4-methoxyphenyl)-3-(trifluoromethyl)-1H-pyrazole;5-(4-Chlorophenyl)-1-(4-methoxyphenyl)-3-trifluoromethylpyrazole;
Density:	1.33 g/cm³
Melting Point:	63 °C
Boiling Point:	440.6 °C at 760 mmHg
Flash Point:	220.3 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36
PSA:	27.05000
LogP:	5.22010

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Specification

The 1H-Pyrazole,5-(4-chlorophenyl)-1-(4-methoxyphenyl)-3-(trifluoromethyl)-, with the CAS registry number 188817-13-2, is also known as 5-(4-Chlorophenyl)-1-(4-methoxyphenyl)-3-trifluoromethylpyrazole. This chemical's molecular formula is C₁₇H₁₂ClF₃N₂O and molecular weight is 352.74. What's more, its systematic name is 5-(4-Chlorophenyl)-1-(4-methoxyphenyl)-3-(trifluoromethyl)-1H-pyrazole and its storage temperature is 2-8 °C.

Physical properties of 1H-Pyrazole,5-(4-chlorophenyl)-1-(4-methoxyphenyl)-3-(trifluoromethyl)- are: (1)ACD/LogP: 5.82; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 27.05 Å²; (7)Index of Refraction: 1.563; (8)Molar Refractivity: 86.2 cm³; (9)Molar Volume: 265.2 cm³; (10)Polarizability: 34.17×10^-24cm³; (11)Surface Tension: 37.4 dyne/cm; (12)Density: 1.33 g/cm³; (13)Flash Point: 220.3 °C; (14)Enthalpy of Vaporization: 67.08 kJ/mol; (15)Boiling Point: 440.6 °C at 760 mmHg; (16)Vapour Pressure: 1.51E-07 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c2nn(c1ccc(OC)cc1)c(c2)c3ccc(Cl)cc3
(2)InChI: InChI=1/C17H12ClF3N2O/c1-24-14-8-6-13(7-9-14)23-15(10-16(22-23)17(19,20)21)11-2-4-12(18)5-3-11/h2-10H,1H3
(3)InChIKey: PQUGCKBLVKJMNT-UHFFFAOYSA-N