Chemical Properties of Nicolaioidesin A

Nicolaioidesin A

InChI
InChI=1S/C26H30O4/c1-16(2)10-12-20-17(3)11-13-21(18-8-6-5-7-9-18)24(20)26(29)25-22(27)14-19(30-4)15-23(25)28/h5-11,14-15,20-21,24,27-28H,12-13H2,1-4H3
InChI Key
LYDZCXVWCFJAKQ-UHFFFAOYSA-N
Formula
C26H30O4
SMILES
COc1cc(O)c(C(=O)C2C(CC=C(C)C)C(C)=CCC2c2ccccc2)c(O)c1
Molecular Weight1
406.52
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Physical Properties

Property Value Unit Source
ΔfusH° 58.84 kJ/mol Joback Calculated Property
logPoct/wat 6.012 Crippen Calculated Property
McVol 329.400 ml/mol McGowan Calculated Property
Inp [3083.10; 3083.10]   Show Hide
Inp 3083.10 NIST
Inp 3083.10 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 [1156.63; 1279.39] J/mol×K [1108.74; 1368.62] Show Hide
Cp,gas 1156.63 J/mol×K 1108.74 Joback Calculated Property
Cp,gas 1176.16 J/mol×K 1152.05 Joback Calculated Property
Cp,gas 1195.73 J/mol×K 1195.37 Joback Calculated Property
Cp,gas 1215.59 J/mol×K 1238.68 Joback Calculated Property
Cp,gas 1235.99 J/mol×K 1281.99 Joback Calculated Property
Cp,gas 1257.17 J/mol×K 1325.31 Joback Calculated Property
Cp,gas 1279.39 J/mol×K 1368.62 Joback Calculated Property

Similar Compounds

Panduratin A. Nicolaioidesin B. Nicolaioidesin C. Vobassan-17-oic acid, 4-demethyl-3-oxo-, methyl ester. Nalmefene, bis(trifluoroacetate). Poligodial + o-Tyr (ethyl ester) adduct (R,S), acetylated, # 2. Poligodial + o-Tyr (ethyl ester) adduct (R,S), acetylated, # 1. 6-Tetrahydrocannabinol, TMS. 9H-Purine, 9-[2-deoxy-3-O-(trimethylsilyl)-«beta»-D-erythro-pentofuranosyl]-6-(trimethylsiloxy)-2-[(trimethylsilyl)amino]-, 5'-[bis(trimethylsilyl) phospate]. Guanosine, N-trimethylsilyl-, 2',3',5'-tris(trimethylsilyl) ether. BUPRENORPHINE. Thymidine, 3'-O-acetyl, 5'-O-cyclotetramethylene-isopropylsilyl. N6-(cyclotetramethylene-tertbutylsilyl)-Adenosine, 2',3',5'-tris-O-TBDMS. (1,S,2S,3R,5S)-(+)-Pinanediol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. Hydromorphone, tert-butyldimethylsilyl ether.

Find more compounds similar to Nicolaioidesin A.

Sources

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