Chemical Properties of 3-(1'-methylbutylidene)-4,5-dihydrophthalide

3-(1'-methylbutylidene)-4,5-dihydrophthalide

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InChI
InChI=1S/C13H18O/c1-3-6-10(2)13-12-8-5-4-7-11(12)9-14-13/h4,7H,3,5-6,8-9H2,1-2H3/b13-10-
InChI Key
JKOMDTBYVZIMAG-RAXLEYEMSA-N
Formula
C13H18O
SMILES
CCCC(C)=C1OCC2=C1CCC=C2
Molecular Weight1
190.28
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Physical Properties

Property Value Unit Source
Δf 150.65 kJ/mol Joback Calculated Property
Δfgas -116.99 kJ/mol Joback Calculated Property
Δfus 25.91 kJ/mol Joback Calculated Property
Δvap 52.78 kJ/mol Joback Calculated Property
log10WS -4.20 Crippen Calculated Property
logPoct/wat 3.737 Crippen Calculated Property
McVol 165.280 ml/mol McGowan Calculated Property
Pc 2505.01 kPa Joback Calculated Property
Inp 1702.00 NIST
Tboil 574.22 K Joback Calculated Property
Tc 793.83 K Joback Calculated Property
Tfus 319.60 K Joback Calculated Property
Vc 0.632 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [410.98; 499.26] J/mol×K [574.22; 793.83] Show Hide
Cp,gas 410.98 J/mol×K 574.22 Joback Calculated Property
Cp,gas 428.21 J/mol×K 610.82 Joback Calculated Property
Cp,gas 444.33 J/mol×K 647.42 Joback Calculated Property
Cp,gas 459.42 J/mol×K 684.03 Joback Calculated Property
Cp,gas 473.55 J/mol×K 720.63 Joback Calculated Property
Cp,gas 486.80 J/mol×K 757.23 Joback Calculated Property
Cp,gas 499.26 J/mol×K 793.83 Joback Calculated Property

Similar Compounds

3n-valeryl-4,5-dihydrophthalide. (Z)-3-Pentylidene-4,5-dihydroisobenzofuran-1(3H)-one. (E)-Ligustilide. cis-ligustilide. (Z)-3-Butylidene-4,5-dihydroisobenzofuran-1(3H)-one. (E)-3-Butylidene-4,5-dihydroisobenzofuran-1(3H)-one. «gamma»-Ponalactone. Prednisone, tetra-TMS. Tetrazepam M (hydroxy-), isomer 2, hydrolysis, acetylated. (2S,3S)-Butane-2,3-diol, 2-(N,N-dimethylaminomethyl)-ferroceneboronate. trans-2,3-Tetralinediol, ferrocenylboronate. Pinacol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. 4',5'-Diiodofluorescein. Triamcinolone Acetonide. Triamcinolone diacetate.

Find more compounds similar to 3-(1'-methylbutylidene)-4,5-dihydrophthalide.

Sources

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