Chemical Properties of 3,4-Dioxymethylenebenzylidene-p-chlorophenylacetonitrile (CAS 104089-74-9)

3,4-Dioxymethylenebenzylidene-p-chlorophenylacetonitrile

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InChI
InChI=1S/C16H10ClNO2/c17-14-4-2-12(3-5-14)13(9-18)7-11-1-6-15-16(8-11)20-10-19-15/h1-8H,10H2/b13-7+
InChI Key
DLQRXFJDEIGQFF-NTUHNPAUSA-N
Formula
C16H10ClNO2
SMILES
N#CC(=Cc1ccc2c(c1)OCO2)c1ccc(Cl)cc1
Molecular Weight1
283.71
CAS
104089-74-9
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Physical Properties

Property Value Unit Source
ΔfG° 368.91 kJ/mol Joback Calculated Property
ΔfH°gas 150.79 kJ/mol Joback Calculated Property
ΔfusH° 41.73 kJ/mol Joback Calculated Property
ΔvapH° 81.89 kJ/mol Joback Calculated Property
log10WS -5.26 Crippen Calculated Property
logPoct/wat 4.133 Crippen Calculated Property
McVol 198.980 ml/mol McGowan Calculated Property
Pc 2507.52 kPa Joback Calculated Property
Tboil 842.64 K Joback Calculated Property
Tc 1109.41 K Joback Calculated Property
Tfus 511.67 K Joback Calculated Property
Vc 0.771 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [528.31; 587.14] J/mol×K [842.64; 1109.41] Show Hide
Cp,gas 528.31 J/mol×K 842.64 Joback Calculated Property
Cp,gas 539.40 J/mol×K 887.10 Joback Calculated Property
Cp,gas 549.75 J/mol×K 931.56 Joback Calculated Property
Cp,gas 559.53 J/mol×K 976.02 Joback Calculated Property
Cp,gas 568.91 J/mol×K 1020.48 Joback Calculated Property
Cp,gas 578.06 J/mol×K 1064.94 Joback Calculated Property
Cp,gas 587.14 J/mol×K 1109.41 Joback Calculated Property

Similar Compounds

3,4-Dioxymethylenebenzylidenephenylacetonitrile. 3,4-Dioxymethylene-p-isopropylphenylacetonitrile. p-Methoxybenzylidene-p-chlorophenylacetonitrile. (E)-9-(Benzo[d][1,3]dioxol-5-yl)-1-(pyrrolidin-1-yl)non-8-en-1-one. (2E,4E,8E)-9-(Benzo[d][1,3]dioxol-5-yl)-N-isobutylnona-2,4,8-trienamide. (E)-9-(Benzo[d][1,3]dioxol-5-yl)-1-(piperidin-1-yl)non-8-en-1-one. (E)-11-(Benzo[d][1,3]dioxol-5-yl)-1-(piperidin-1-yl)undec-10-en-1-one. (E)-7-(Benzo[d][1,3]dioxol-5-yl)-1-(pyrrolidin-1-yl)hept-6-en-1-one. (2E,4E,12E)-13-(Benzo[d][1,3]dioxol-5-yl)-N-isobutyltrideca-2,4,12-trienamide. N-Isobutyl-11-(3,4-methylenedioxyphenyl)-2E,4E,10E-undecatrienoic amide. (E)-7-(Benzo[d][1,3]dioxol-5-yl)-1-(piperidin-1-yl)hept-6-en-1-one. (2E,10E)-11-(Benzo[d][1,3]dioxol-5-yl)-1-(piperidin-1-yl)undeca-2,10-dien-1-one. (E)-3-(Benzo[d][1,3]dioxol-5-yl)-1-(piperidin-1-yl)prop-2-en-1-one. (2E,8E)-9-(Benzo[d][1,3]dioxol-5-yl)-1-(piperidin-1-yl)nona-2,8-dien-1-one. Feruloyliupinine.

Find more compounds similar to 3,4-Dioxymethylenebenzylidene-p-chlorophenylacetonitrile.

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