CAS Registry Number®
98-46-4
CAS Name
5-Nitrobenzotrifluoride
Molecular Formula
C7H4F3NO2
Molecular Mass
191.11
Compound Properties
-
Boiling Point (1)
203 °C
-
Melting Point (2)
-2.4 °C
-
Density (1)
1.437 g/cm³ @ Temp: 15.5 °C
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
- (2) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C7H4F3NO2/c8-7(9,10)5-2-1-3-6(4-5)11(12)13/h1-4H
InChIKey
InChIKey=WHNAMGUAXHGCHH-UHFFFAOYSA-N
SMILES
C(F)(F)(F)C1=CC(N(=O)=O)=CC=C1
Canonical SMILES
O=N(=O)C1=CC=CC(=C1)C(F)(F)F
Other Names for this Substance
- Benzene, 1-nitro-3-(trifluoromethyl)-
- Toluene, α,α,α-trifluoro-m-nitro-
- 1-Nitro-3-(trifluoromethyl)benzene
- m-(Trifluoromethyl)nitrobenzene
- α,α,α-Trifluoro-m-nitrotoluene
- m-Nitrobenzotrifluoride
- 3-(Trifluoromethyl)nitrobenzene
- 3-Nitrobenzotrifluoride
- m-Nitro-α,α,α-trifluorotoluene
- 3-(Trifluoromethyl)-1-nitrobenzene
- 3-Nitro-1-(trifluoromethyl)benzene
- α,α,α-Trifluoro-3-nitrotoluene
- 5-Nitrobenzotrifluoride
- NSC 10313
- m-Nitro(trifluoromethyl)benzene
