654-70-6

Name 4-Amino-2-(trifluoromethyl)benzonitrile
CAS 654-70-6
EINECS(EC#) -0
Molecular Formula C8H5F3N2
MDL Number MFCD00042155
Molecular Weight 186.13
MOL File 654-70-6.mol
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Chemical Properties

Appearance Off-White Solid
Melting point  141-145 °C(lit.)
Boiling point  294.5±40.0 °C(Predicted)
density  1.37±0.1 g/cm3(Predicted)
storage temp.  Keep in dark place,Sealed in dry,Room Temperature
solubility  DMSO (Sparingly), Methanol (Slightly)
form  Powder
pka 0.50±0.10(Predicted)
color  White to off-white
BRN  3278074
InChI InChI=1S/C8H5F3N2/c9-8(10,11)7-3-6(13)2-1-5(7)4-12/h1-3H,13H2
InChIKey PMDYLCUKSLBUHO-UHFFFAOYSA-N
SMILES C(#N)C1=CC=C(N)C=C1C(F)(F)F
CAS DataBase Reference 654-70-6(CAS DataBase Reference)
NIST Chemistry Reference 5-Amino-2-cyanobenzotrifluoride(654-70-6)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H317
Precautionary statements  P261-P264-P280-P301+P312+P330-P302+P352-P333+P313
Hazard Codes  Xn,T
Risk Statements 
R22:Harmful if swallowed.
R43:May cause sensitization by skin contact.
R36/37/38:Irritating to eyes, respiratory system and skin .
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
Safety Statements 
S36:Wear suitable protective clothing .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S37/39:Wear suitable gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
RIDADR  3439
WGK Germany  3
Hazard Note  Toxic
REACH Registrations Active
HazardClass  6.1
PackingGroup  III
HS Code  29269090
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Skin Sens. 1

Hazard Information

Material Safety Data Sheet(MSDS)

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