3,5-Dinitrobenzotrifluoride
CAS Registry Number®
401-99-0
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CAS Name
3,5-DinitrobenzotrifluorideMolecular Formula
C7H3F3N2O4Molecular Mass
236.10Cite this Page
3,5-Dinitrobenzotrifluoride. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=401-99-0 (retrieved ) (CAS RN: 401-99-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
125-127 °C @ Press: 9 TorrMelting Point (2)
49-50 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C7H3F3N2O4/c8-7(9,10)4-1-5(11(13)14)3-6(2-4)12(15)16/h1-3H
InChIKey
InChIKey=QZADIXWDDVQVKM-UHFFFAOYSA-N
SMILES
C(F)(F)(F)C1=CC(N(=O)=O)=CC(N(=O)=O)=C1
Canonical SMILES
O=N(=O)C=1C=C(C=C(C1)C(F)(F)F)N(=O)=O
Other Names for this Substance
- Benzene, 1,3-dinitro-5-(trifluoromethyl)-
- Toluene, α,α,α-trifluoro-3,5-dinitro-
- 1,3-Dinitro-5-(trifluoromethyl)benzene
- 3,5-Dinitrobenzotrifluoride
- α,α,α-Trifluoro-3,5-dinitrotoluene
