Chemical Properties of 3,4-Difluorocinnamic acid (CAS 112897-97-9)

3,4-Difluorocinnamic acid

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InChI
InChI=1S/C9H6F2O2/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5H,(H,12,13)/b4-2+
InChI Key
HXBOHZQZTWAEHJ-DUXPYHPUSA-N
Formula
C9H6F2O2
SMILES
O=C(O)C=Cc1ccc(F)c(F)c1
Molecular Weight1
184.14
CAS
112897-97-9
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Physical Properties

Property Value Unit Source
Δf -457.09 kJ/mol Joback Calculated Property
Δfgas -555.31 kJ/mol Joback Calculated Property
Δfus 24.38 kJ/mol Joback Calculated Property
Δvap 60.98 kJ/mol Joback Calculated Property
log10WS -2.48 Crippen Calculated Property
logPoct/wat 2.063 Crippen Calculated Property
McVol 120.590 ml/mol McGowan Calculated Property
Pc 3611.55 kPa Joback Calculated Property
Tboil 590.71 K Joback Calculated Property
Tc 785.69 K Joback Calculated Property
Tfus 349.50 K Joback Calculated Property
Vc 0.472 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [275.34; 318.57] J/mol×K [590.71; 785.69] Show Hide
Cp,gas 275.34 J/mol×K 590.71 Joback Calculated Property
Cp,gas 283.75 J/mol×K 623.21 Joback Calculated Property
Cp,gas 291.65 J/mol×K 655.70 Joback Calculated Property
Cp,gas 299.05 J/mol×K 688.20 Joback Calculated Property
Cp,gas 305.99 J/mol×K 720.70 Joback Calculated Property
Cp,gas 312.48 J/mol×K 753.20 Joback Calculated Property
Cp,gas 318.57 J/mol×K 785.69 Joback Calculated Property

Similar Compounds

m-fluorocinnamic acid. 4-Fluorocinnamic acid. 2,5-Difluorocinnamic acid. 3,5-Difluorocinnamic acid. 2-Propenoic acid, 3-(2-fluorophenyl)-. 4-Bromo-2-fluorocinnamic acid. 2-Propenoic acid, 3-phenyl-. (Z)-3-Phenyl-2-propenoic acid. trans-Cinnamic acid. p-Chlorocinnamic acid. p-Methylcinnamic acid. 2-Propenoic acid, 3-(4-hydroxyphenyl)-, (Z)-. p-Coumaric acid. p-Coumaric acid, trans. 4-Nitrocinnamic acid.

Find more compounds similar to 3,4-Difluorocinnamic acid.

Sources

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