Chemical Properties of Benzaldehyde, 4-(trifluoromethyl)- (CAS 455-19-6)

Benzaldehyde, 4-(trifluoromethyl)-

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InChI
InChI=1S/C8H5F3O/c9-8(10,11)7-3-1-6(5-12)2-4-7/h1-5H
InChI Key
BEOBZEOPTQQELP-UHFFFAOYSA-N
Formula
C8H5F3O
SMILES
O=Cc1ccc(C(F)(F)F)cc1
Molecular Weight1
174.12
CAS
455-19-6
Other Names
  • «alpha»,«alpha»,«alpha»-Trifluoro-p-tolualdehyde
  • 4-Trifluoromethylbenzaldehyde
  • p-Trifluoromethylbenzaldehyde
  • p-CF3C6H4CHO
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Physical Properties

Property Value Unit Source
PAff 805.60 kJ/mol NIST
BasG 773.80 kJ/mol NIST
EA [0.94; 0.97] eV Show Hide
EA 0.94 ± 0.09 eV NIST
EA 0.97 ± 0.09 eV NIST
Δf -561.85 kJ/mol Joback Calculated Property
Δfgas -666.05 kJ/mol Joback Calculated Property
Δfus 14.24 kJ/mol Joback Calculated Property
Δvap 39.31 kJ/mol Joback Calculated Property
log10WS -2.82 Crippen Calculated Property
logPoct/wat 2.518 Crippen Calculated Property
McVol 106.700 ml/mol McGowan Calculated Property
Pc 3411.87 kPa Joback Calculated Property
Tboil 457.34 K Joback Calculated Property
Tc 654.26 K Joback Calculated Property
Tfus 265.05 K Joback Calculated Property
Vc 0.435 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [222.36; 274.75] J/mol×K [457.34; 654.26] Show Hide
Cp,gas 222.36 J/mol×K 457.34 Joback Calculated Property
Cp,gas 232.79 J/mol×K 490.16 Joback Calculated Property
Cp,gas 242.49 J/mol×K 522.98 Joback Calculated Property
Cp,gas 251.50 J/mol×K 555.80 Joback Calculated Property
Cp,gas 259.86 J/mol×K 588.62 Joback Calculated Property
Cp,gas 267.59 J/mol×K 621.44 Joback Calculated Property
Cp,gas 274.75 J/mol×K 654.26 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr [339.70; 353.50] K [1.70; 3.30] Show Hide
Tboilr 339.70 K 1.70 NIST
Tboilr 353.50 ± 0.50 K 3.30 NIST

Similar Compounds

1,4-Benzenedicarboxaldehyde. Benzaldehyde, 3-(trifluoromethyl)-. 4-(Trifluoromethyl)benzoyl chloride. Benzonitrile, 4-formyl-. Tolualdehyde. Benzaldehyde, 4-methyl-. 2-Fluoro-4-(trifluoromethyl)benzaldehyde. Benzaldehyde, 2-(trifluoromethyl)-. Benzene, 1,4-bis(trifluoromethyl)-. Benzaldehyde. «alpha»,«alpha»,«alpha»-trifluoro-p-toluic acid. 4-Trifluoromethylbenzyl chloride. Benzoic acid, 4-formyl-. 4-Trifluoromethyl-«alpha»,«alpha»,«alpha»-trifluoroacetophenone. Benzaldehyde, 4-chloro-.

Find more compounds similar to Benzaldehyde, 4-(trifluoromethyl)-.

Sources

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