Chemical Properties of Spirafolide (CAS 130838-06-1)

Spirafolide

InChI
InChI=1S/C15H18O3/c1-9-8-17-7-6-15(3)5-4-11-10(2)14(16)18-13(11)12(9)15/h6-8,11-13H,2,4-5H2,1,3H3
InChI Key
CHJVABAWMKQXSI-UHFFFAOYSA-N
Formula
C15H18O3
SMILES
C=C1C(=O)OC2C1CCC1(C)C=COC=C(C)C21
Molecular Weight1
246.30
CAS
130838-06-1
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Physical Properties

Property Value Unit Source
ΔfusH° 30.73 kJ/mol Joback Calculated Property
logPoct/wat 2.948 Crippen Calculated Property
McVol 190.040 ml/mol McGowan Calculated Property
Inp 1993.90 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [543.81; 639.49] J/mol×K [659.03; 886.61] Show Hide
Cp,gas 543.81 J/mol×K 659.03 Joback Calculated Property
Cp,gas 561.92 J/mol×K 696.96 Joback Calculated Property
Cp,gas 578.93 J/mol×K 734.89 Joback Calculated Property
Cp,gas 595.01 J/mol×K 772.82 Joback Calculated Property
Cp,gas 610.35 J/mol×K 810.75 Joback Calculated Property
Cp,gas 625.12 J/mol×K 848.68 Joback Calculated Property
Cp,gas 639.49 J/mol×K 886.61 Joback Calculated Property

Similar Compounds

10-Epigazaniolide. Gazaniolide. 2(3H)-Benzofuranone, 6-ethenylhexahydro-6-methyl-3-methylene-7-(1-methylethenyl)-, [3aS-(3a«alpha»,6«alpha»,7«beta»,7a«beta»)]-. Santamarine. Senkyunolide P. Reynosin. Azuleno[4,5-b]furan-2(3H)-one, 3a,4,6a,7,8,9,9a,9b-octahydro-6-methyl-3,9-bis(methylene)-, [3aS-(3a«alpha»,6a«alpha»,9a«alpha»,9b«beta»)]-. GA3-3.beta.-O-glucoside, permethylated. GA7-3.beta.-O-glucoside, permethylated. GA3-13-O-glucoside, permethylated. GA5-13-O-«beta»-D-glucopyranoside, permethyl. «gamma»-Ponalactone. Benazepril Me. azadirachtin. Morphinan-6-ol, 4,5-epoxy-3-methoxy-17-methyl-, (5«alpha»,6«alpha»)-.

Find more compounds similar to Spirafolide.

Sources

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