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401-94-5

401-94-5 Structure

401-94-5 Structure
IdentificationMore
[Name]

3-AMINO-5-NITROBENZOTRIFLUORIDE
[CAS]

401-94-5
[Synonyms]

3-AMINO-5-NITROBENZOTRIFLUORIDE
3-NITRO-5-(TRIFLUOROMETHYL)ANILINE
3-NITRO-5-TRIFLUOROMETHYL-PHENYLAMINE
3-Amino-5-Nitrobenzotrifluoride96%
3-Amino-5-nitrobenzotrifluoroide
3-Nitro-5-(trifluoromethyl)benzenamine
5-Nitro-α,α,α-trifluoro-m-toluidine
[Molecular Formula]

C7H5F3N2O2
[MDL Number]

MFCD00061229
[Molecular Weight]

206.12
[MOL File]

401-94-5.mol
Chemical PropertiesBack Directory
[Melting point ]

77-81°C
[Boiling point ]

280.7±40.0 °C(Predicted)
[density ]

1.503±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[pka]

1.08±0.10(Predicted)
[Appearance]

Light yellow to yellow Solid
[InChI]

InChI=1S/C7H5F3N2O2/c8-7(9,10)4-1-5(11)3-6(2-4)12(13)14/h1-3H,11H2
[InChIKey]

LTVWXWWSCLXXAT-UHFFFAOYSA-N
[SMILES]

C1(N)=CC(C(F)(F)F)=CC([N+]([O-])=O)=C1
[CAS DataBase Reference]

401-94-5(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)
GHS06
[Signal word ]

Warning
[Hazard statements ]

H302-H311-H315-H319-H332
[Precautionary statements ]

P280h-P305+P351+P338-P309-P310
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S36:Wear suitable protective clothing .
[RIDADR ]

2811
[Hazard Note ]

Irritant
[HazardClass ]

6.1
[PackingGroup ]

[HS Code ]

2921420090
Spectrum DetailBack Directory
[Spectrum Detail]

3-AMINO-5-NITROBENZOTRIFLUORIDE(401-94-5)1HNMR
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