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401-95-6

Name 3,5-Bis(trifluoromethyl)benzaldehyde
CAS 401-95-6
EINECS(EC#) 202-860-4
Molecular Formula C9H4F6O
MDL Number MFCD00010206
Molecular Weight 242.12
MOL File 401-95-6.mol
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Chemical Properties

Appearance clear colorless to yellow liquid
Boiling point  37 °C1.3 mm Hg(lit.)
density  1.469 g/mL at 25 °C(lit.)
refractive index  n20/D 1.422(lit.)
Fp  158 °F
storage temp.  Keep in dark place,Sealed in dry,Room Temperature
form  Liquid
color  Clear colorless to yellow
Specific Gravity 1.469
Water Solubility  Insoluble in water. Soluble in many organic solvents.
Sensitive  Air Sensitive
BRN  1884058
InChI InChI=1S/C9H4F6O/c10-8(11,12)6-1-5(4-16)2-7(3-6)9(13,14)15/h1-4H
InChIKey LDWLIXZSDPXYDR-UHFFFAOYSA-N
SMILES C(=O)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1
CAS DataBase Reference 401-95-6(CAS DataBase Reference)
NIST Chemistry Reference 3,5-Bis(trifluoromethyl)benzaldehyde(401-95-6)

Safety Data

Hazard Codes  Xi,Xn
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
R22:Harmful if swallowed.
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
WGK Germany  3
F  10-21
Hazard Note  Irritant
HazardClass  IRRITANT
HS Code  29124990

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