3-Fluoro-4-nitrobenzotrifluoride supplier

Name
3-FLUORO-4-NITROBENZOTRIFLUORIDE
EINECS
CAS No. 402-12-0
Density 1.504 g/cm³
Solubility
Melting Point
Formula C₇H₃F₄NO₂
Boiling Point 219.9 °C at 760 mmHg
Molecular Weight 209.1
Flash Point 86.8 °C
Transport Information
Appearance Light yellow powder
Safety 39
Risk Codes 34
Molecular Structure
Hazard Symbols Xi
Synonyms Toluene,4-nitro-3-fluoro-a,a,a-trifluoro- (8CI);2-Fluoro-4-trifluoromethylnitrobenzene;
PSA 45.82000
LogP 3.27590

3-Fluoro-4-nitrobenzotrifluoride Specification

The Benzene,2-fluoro-1-nitro-4-(trifluoromethyl)-, with the CAS registry number 402-12-0, is also known as 3-Fluoro-4-nitrobenzotrifluoride. This chemical's molecular formula is C₇H₃F₄NO₂ and formula weight is 209.10. What's more, its IUPAC name is 2-fluoro-1-nitro-4-(trifluoromethyl)benzene. It is irritant.

Physical properties of Benzene,2-fluoro-1-nitro-4-(trifluoromethyl)- are: (1)ACD/LogP: 2.13; (2)#H bond acceptors: 3; (3)#H bond donors: 0; (4)#Freely Rotating Bonds: 1; (5)Polar Surface Area: 45.82 Å²; (6)Index of Refraction: 1.455; (7)Molar Refractivity: 37.77 cm³; (8)Molar Volume: 138.9 cm³; (9)Surface Tension: 30.6 dyne/cm; (10)Density: 1.504 g/cm³; (11)Flash Point: 86.8 °C; (12)Enthalpy of Vaporization: 43.78 kJ/mol; (13)Boiling Point: 219.9 °C at 760 mmHg; (14)Vapour Pressure: 0.172 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=C(C=C1C(F)(F)F)F)[N+](=O)[O-]
(2)InChI: InChI=1S/C7H3F4NO2/c8-5-3-4(7(9,10)11)1-2-6(5)12(13)14/h1-3H
(3)InChIKey: OBWDPLOCTVOTMA-UHFFFAOYSA-N

Product Name

3-FLUORO-4-NITROBENZOTRIFLUORIDE

3-Fluoro-4-nitrobenzotrifluoride Specification

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