3-Nitrobenzotrifluoride
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Product Description
Product
3-Nitrobenzotrifluoride
CAS
98-46-4
Formula
C7H4F3NO2
Synonym
3-Nitrobenzotrifluoride; a,a,a-Trifluoro-3-nitrotoluene; a,a,a-Trifluoro-m-nitrotoluene; Benzene, 1-trifluoromethyl-3-nitro; m-(Trifluoromethyl)nitrobenzene; M-NITRO-A,A,A-TRIFLUOROTOLUENE; m-Nitrobenzotrifluoride; m-Nitrotrifluorotoluene; m-Nitrotrifluortoluol; Nitrobenzotrifluoride; NSC 10313; Toluene, 3-nitro-a,a,a-trifluoro-; Toluene, a,a,a-trifluoro-m-nitro-; USAF MA-5; 1,3-Nitrobenzotrifluoride; 1-nitro-3-(trifluoromethyl)-benzen; 1-Nitro-3-(trifluoromethyl)benzene; 1-trifluoromethyl-3-nitrobenzene; 3-(Trifluoromethyl)nitrobenzene; 3-Nitro-a,a,a-trifluorotoluene
Typical Product Specifications
Molecular weight
191.11
EINECS
202-670-1
SMILES
c1(cc(ccc1)[N+](=O)[O-])C(F)(F)F
InChI
1S/C7H4F3NO2/c8-7(9,10)5-2-1-3-6(4-5)11(12)13/h1-4H
InChIKey
WHNAMGUAXHGCHH-UHFFFAOYSA-N
Vapor Pressure
0.259 mm Hg
Water solubility
114 mg/L
Melting Point
-2.40E+00 ° C
Boiling Point
202.8 ° C
log P (octanol-water)
2.62
Atmospheric OH Rate Constant
4.90E-14 cm3/molecule-sec
Henry's Law Constant
1.85E-04 atm-m3/mole
Boiling Point
200-205 °C
BRN Number
2051362
Density
1.436 g/mL at 25 °C
Melting Point
-5 °C
Water solubility
0.4 g/L (20 ºC)
Refractive Index
1.472
Flash Point
190 °F
Class
3-Nitrobenzotrifluoride
Product Description
Product
3-Nitrobenzotrifluoride
CAS
98-46-4
Formula
C7H4F3NO2
Synonym
3-Nitrobenzotrifluoride; a,a,a-Trifluoro-3-nitrotoluene; a,a,a-Trifluoro-m-nitrotoluene; Benzene, 1-trifluoromethyl-3-nitro; m-(Trifluoromethyl)nitrobenzene; M-NITRO-A,A,A-TRIFLUOROTOLUENE; m-Nitrobenzotrifluoride; m-Nitrotrifluorotoluene; m-Nitrotrifluortoluol; Nitrobenzotrifluoride; NSC 10313; Toluene, 3-nitro-a,a,a-trifluoro-; Toluene, a,a,a-trifluoro-m-nitro-; USAF MA-5; 1,3-Nitrobenzotrifluoride; 1-nitro-3-(trifluoromethyl)-benzen; 1-Nitro-3-(trifluoromethyl)benzene; 1-trifluoromethyl-3-nitrobenzene; 3-(Trifluoromethyl)nitrobenzene; 3-Nitro-a,a,a-trifluorotoluene
Typical Product Specifications
Molecular weight
191.11
EINECS
202-670-1
SMILES
c1(cc(ccc1)[N+](=O)[O-])C(F)(F)F
InChI
1S/C7H4F3NO2/c8-7(9,10)5-2-1-3-6(4-5)11(12)13/h1-4H
InChIKey
WHNAMGUAXHGCHH-UHFFFAOYSA-N
Vapor Pressure
0.259 mm Hg
Water solubility
114 mg/L
Melting Point
-2.40E+00 ° C
Boiling Point
202.8 ° C
log P (octanol-water)
2.62
Atmospheric OH Rate Constant
4.90E-14 cm3/molecule-sec
Henry's Law Constant
1.85E-04 atm-m3/mole
Boiling Point
200-205 °C
BRN Number
2051362
Density
1.436 g/mL at 25 °C
Melting Point
-5 °C
Water solubility
0.4 g/L (20 ºC)
Refractive Index
1.472
Flash Point
190 °F
Class
