Chemical Properties of protoanemonin (CAS 90921-11-2)

protoanemonin

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InChI
InChI=1S/C10H8O4/c11-7-1-3-9(13-7)5-6-10(9)4-2-8(12)14-10/h1-4H,5-6H2
InChI Key
JLUQTCXCAFSSLD-UHFFFAOYSA-N
Formula
C10H8O4
SMILES
O=C1C=CC2(CCC23C=CC(=O)O3)O1
Molecular Weight1
192.17
CAS
90921-11-2
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Physical Properties

Property Value Unit Source
Δf -181.50 kJ/mol Joback Calculated Property
Δfgas -422.83 kJ/mol Joback Calculated Property
Δfus 13.52 kJ/mol Joback Calculated Property
Δvap 54.21 kJ/mol Joback Calculated Property
log10WS -1.35 Crippen Calculated Property
logPoct/wat 0.484 Crippen Calculated Property
McVol 125.460 ml/mol McGowan Calculated Property
Pc 4652.99 kPa Joback Calculated Property
Inp [895.00; 895.00]   Show Hide
Inp 895.00 NIST
Inp 895.00 NIST
Tboil 654.24 K Joback Calculated Property
Tc 937.51 K Joback Calculated Property
Tfus 488.86 K Joback Calculated Property
Vc 0.468 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [351.72; 438.81] J/mol×K [654.24; 937.51] Show Hide
Cp,gas 351.72 J/mol×K 654.24 Joback Calculated Property
Cp,gas 366.28 J/mol×K 701.45 Joback Calculated Property
Cp,gas 380.23 J/mol×K 748.66 Joback Calculated Property
Cp,gas 394.01 J/mol×K 795.87 Joback Calculated Property
Cp,gas 408.07 J/mol×K 843.09 Joback Calculated Property
Cp,gas 422.85 J/mol×K 890.30 Joback Calculated Property
Cp,gas 438.81 J/mol×K 937.51 Joback Calculated Property

Similar Compounds

9,11-didehydro GA4. Gibberellic acid. Riesling acetal. 2,2,6,8-Tetramethyl-7,11-dioxatricyclo(6.2.1.0)-1,6-undec-4-ene. Me-dihydrophaseic acid. epi-Me-dihydrophaseic acid. Riesling acetal. GA73, Me. GA73 Methyl ester, [D2]. Me-2-trans-dihydrophaseic acid. epi-Me-2-trans-dihydrophaseic acid. GA122 (1,2-didehydro GA69), MeTMS. GA121-isolactone, MeTMS. GA122-isolactone, MeTMS. GA121 (1,2-didehydro GA70), MeTMS.

Find more compounds similar to protoanemonin.

Sources

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