Chemical Property of 1-Fluoro-2,4,6-trinitrobenzene
Chemical Property:
- Vapor Pressure:6.36E-05mmHg at 25°C
- Boiling Point:355.5°Cat760mmHg
- Flash Point:168.8°C
- PSA：137.46000
- Density:1.789g/cm3
- LogP:3.11990
- XLogP3:0.8
- Hydrogen Bond Donor Count:0
- Hydrogen Bond Acceptor Count:7
- Rotatable Bond Count:0
- Exact Mass:230.99276295
- Heavy Atom Count:16
- Complexity:296
- Purity/Quality:
-
99% *data from raw suppliers
2,4,6-TRINITROFLUOROBENZENE 95.00% *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:C1=C(C=C(C(=C1[N+](=O)[O-])F)[N+](=O)[O-])[N+](=O)[O-]
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General Description
1-Fluoro-2,4,6-trinitrobenzene is a nitroaromatic energetic compound whose sensitivity and thermostability can be predicted more accurately using modern computational methods such as Hirshfeld surface analysis and fingerprint plot analysis, rather than traditional models based on bond dissociation enthalpy or electrostatic potential. These advanced techniques provide better correlations with experimental data, enhancing the understanding of its structure-property relationships. Continued research with larger sample sizes will further refine predictive accuracy for this and similar energetic materials.
