Chemical Properties of «gamma»-Ponalactone

«gamma»-Ponalactone

InChI
InChI=1S/C19H22O6/c1-7(2)12-8-5-10-14-18(3,9(8)6-11(20)24-12)16-13(25-16)15(21)19(14,4)17(22)23-10/h5-7,10,12-16,21H,1-4H3/t10-,12-,13?,14-,15+,16?,18-,19-/m1/s1
InChI Key
KDORDIOOUCRJPK-TUGODLKSSA-N
Formula
C19H22O6
SMILES
CC(C)C1OC(=O)C=C2C1=CC1OC(=O)C3(C)C(O)C4OC4C2(C)C13
Molecular Weight1
346.37
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Physical Properties

Property Value Unit Source
ΔfusH° 49.41 kJ/mol Joback Calculated Property
logPoct/wat 1.130 Crippen Calculated Property
McVol 242.290 ml/mol McGowan Calculated Property
I 2029.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [354.43; 915.59] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-2.21610e+02
Coefficient B2.78318e+00
Coefficient C-2.77358e-03
Coefficient D1.12760e-06
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 354.43 J/mol×K 273.00 Calculated Property
Cp,gas 465.81 J/mol×K 353.78 Calculated Property
Cp,gas 556.61 J/mol×K 434.56 Calculated Property
Cp,gas 630.40 J/mol×K 515.33 Calculated Property
Cp,gas 690.74 J/mol×K 596.11 Calculated Property
Cp,gas 741.21 J/mol×K 676.89 Calculated Property
Cp,gas 785.36 J/mol×K 757.67 Calculated Property
Cp,gas 826.76 J/mol×K 838.44 Calculated Property
Cp,gas 868.98 J/mol×K 919.22 Calculated Property
Cp,gas 915.59 J/mol×K 1000.00 Calculated Property

Similar Compounds

azadirachtin. Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, acetate (ester), (5«alpha»,6«alpha»)-. 6-O,N-Diacetylnorcodeine. Strychnine. Thebaine. 3-propionyl-morphine. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). 3-O,6-O,N-Triacetylnormorphine. AJMALINE, M(NOR-), AC. N6-(cyclotetramethylene-tertbutylsilyl)-Adenosine, 2',3',5'-tris-O-TBDMS. (1,S,2S,3R,5S)-(+)-Pinanediol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. Brucine. ERGOTAMINE. Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). DIHYDROERGOKRYPTINE.

Find more compounds similar to «gamma»-Ponalactone.

Sources

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