4-Nitro-3-(trifluoromethyl)aniline
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4-Nitro-3-(trifluoromethyl)aniline
structure -
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CAS No:
393-11-3
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Formula:
C7H5F3N2O2
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Chemical Name:
4-Nitro-3-(trifluoromethyl)aniline
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Synonyms:
Benzenamine,4-nitro-3-(trifluoromethyl)-;m-Toluidine,α,α,α-trifluoro-4-nitro-;4-Nitro-3-(trifluoromethyl)benzenamine;α,α,α-Trifluoro-4-nitro-m-toluidine;3-Trifluoromethyl-4-nitroaniline;4-Nitro-3-(trifluoromethyl)aniline;5-Amino-2-nitrobenzotrifluoride;NSC 10323;(4-Nitro-3-trifluoromethylphenyl)amine;3-Amino-6-nitrobenzotrifluoride
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CAS No:
4-Nitro-3-(trifluoromethyl)aniline Basic Attributes
206.12
206.12
2650702
206-884-6
15YY91105I
10323
DTXSID7057731
29214200
Characteristics
71.8
2.5
yellow crystal
1.4711 (estimate)
129 °C
326.4°C at 760 mmHg
151.2ºC
1.532
Refrigerator
Safety Information
III
6.1
UN2811
2
36/37/38-20/21/22
26-36-36/37
Xi,Xn
Irritant
Stable at room temperature in closed containers under normal storage and handling conditions.
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501
H302
Drug Information
4-nitro-3-(trifluoromethyl)aniline has known human metabolites that include 2-amino-5-nitro-4-(trifluoromethyl)phenol and N-[4-nitro-3-(trifluoromethyl)phenyl]-acetamide.
3-TFM-4-NA
4-Nitro-3-(trifluoromethyl)aniline Use and Manufacturing
4-Nitro-3-(trifluoromethyl)aniline is a metabolite of Flutamide (F598850) (FLU-1 or M2).
Computed Properties
Molecular Weight:206.12
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Exact Mass:206.03031189
Monoisotopic Mass:206.03031189
Topological Polar Surface Area:71.8
Heavy Atom Count:14
Complexity:226
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-Nitro-3-(trifluoromethyl)aniline
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