5-Nitro-2-(trifluoromethyl)benzonitrile supplier

Name
2-Trifluoromethyl-5-Nitrobenzonitrile
EINECS
CAS No. 887350-95-0
Density 1.498 g/cm³
Solubility
Melting Point
Formula C₈H₃F₃N₂O₂
Boiling Point 282.386 °C at 760 mmHg
Molecular Weight 216.12
Flash Point 124.583 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms BENZONITRILE, 5-NITRO-2-(TRIFLUOROMETHYL)-;
PSA 69.61000
LogP 3.00848

5-Nitro-2-(trifluoromethyl)benzonitrile Specification

This chemical is called 2-Trifluoromethyl-5-Nitrobenzonitrile, and it can also be named as 5-nitro-2-(trifluoromethyl)benzonitrile. With the molecular formula of C₈H₃F₃N₂O₂, its molecular weight is 216.12. The CAS registry number of this chemical is 887350-95-0.

Other characteristics of the 2-Trifluoromethyl-5-Nitrobenzonitrile can be summarised as followings: (1)ACD/LogP: 1.99; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 27.03 Å²; (7)Index of Refraction: 1.565; (8)Molar Refractivity: 44.18 cm³; (9)Molar Volume: 135.6 cm³; (10)Polarizability: 17.51×10^-24cm³; (11)Surface Tension: 48.2 dyne/cm; (12)Density: 1.07 g/cm³; (13)Flash Point: 148.7 °C; (14)Enthalpy of Vaporization: 56.41 kJ/mol; (15)Boiling Point: 322.2 °C at 760 mmHg; (16)Vapour Pressure: 0.000283 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: c1cc(c(cc1[N+](=O)[O-])C#N)C(F)(F)F
2.InChI: InChI=1/C8H3F3N2O2/c9-8(10,11)7-2-1-6(13(14)15)3-5(7)4-12/h1-3H
3.InChIKey: KGIRDFJKJWPGLT-UHFFFAOYAR

Product Name

2-Trifluoromethyl-5-Nitrobenzonitrile

5-Nitro-2-(trifluoromethyl)benzonitrile Specification

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