Chemical Properties of 2-Nitro-3,4,6-trifluoroacetanilide (CAS 388-11-4)

2-Nitro-3,4,6-trifluoroacetanilide

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C8H5F3N2O3/c1-3(14)12-7-5(10)2-4(9)6(11)8(7)13(15)16/h2H,1H3,(H,12,14)
InChI Key
CAJSFXVPIMWHPO-UHFFFAOYSA-N
Formula
C8H5F3N2O3
SMILES
CC(=O)Nc1c(F)cc(F)c(F)c1[N+](=O)[O-]
Molecular Weight1
234.13
CAS
388-11-4
Sources

Physical Properties

Property Value Unit Source
Δf -498.04 kJ/mol Joback Calculated Property
Δfgas -676.00 kJ/mol Joback Calculated Property
Δfus 36.26 kJ/mol Joback Calculated Property
Δvap 65.65 kJ/mol Joback Calculated Property
logPoct/wat 1.97 Crippen Calculated Property
Pc 3220.98 kPa Joback Calculated Property
Tboil 682.73 K Joback Calculated Property
Tc 901.68 K Joback Calculated Property
Tfus 504.39 K Joback Calculated Property
Vc 0.55 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 339.40 J/mol×K 682.73 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-F 3
=CH- (ring) 1
-NO2 1
>NH 1
=C< (ring) 5
-CH3 1
>C=O (nonring) 1

Similar Compounds

2,4-Difluoro-6-nitroacetanilide. Acetamide, n,n'-(4,6-difluoro-2-nitro-m-phenylene)bis-. 4'-Fluoro-2'-nitroacetanilide. 2',4'-Dinitro-5'-fluoroacetanilide. Acetamide, N-(2-nitrophenyl)-. Acetamide, n-(4-methoxy-2-nitrophenyl)-. 4'-Bromo-2'-nitroacetanilide. 2,4-Dinitro acetanilide. 4-Ethoxy-2-nitro acetanilide. Acetanilide, 2',4',5'-trifluoro-. 2,3,4,6-Tetrafluoronitrobenzene. Benzene, pentafluoronitro-. Acetamide, n-(3,7-dinitro-9-oxofluoren-2-yl)-,. 2,2,3-Trichloro-n-(4-chloro-2-nitrophenyl)propanamide. Benzene, 1,2,4-trifluoro-5-nitro-.

Find more compounds similar to 2-Nitro-3,4,6-trifluoroacetanilide.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.