Chemical Properties of Nicolaioidesin A (CAS 475579-25-0)

Nicolaioidesin A

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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
406.51
CAS
475579-25-0
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Physical Properties

Property Value Unit Source
Δf -58.90 kJ/mol Joback Calculated Property
Δfgas -550.42 kJ/mol Joback Calculated Property
Δfus 58.84 kJ/mol Joback Calculated Property
Δvap 114.67 kJ/mol Joback Calculated Property
log10WS -6.65 Crippen Calculated Property
logPoct/wat 6.012 Crippen Calculated Property
McVol 329.400 ml/mol McGowan Calculated Property
Pc 1592.35 kPa Joback Calculated Property
Inp [3083.10; 3083.10]   Show Hide
Inp 3083.10 NIST
Inp 3083.10 NIST
Tboil 1108.54 K Joback Calculated Property
Tc 1368.37 K Joback Calculated Property
Tfus 736.88 K Joback Calculated Property
Vc 1.129 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1156.54; 1279.26] J/mol×K [1108.54; 1368.37] Show Hide
Cp,gas 1156.54 J/mol×K 1108.54 Joback Calculated Property
Cp,gas 1176.07 J/mol×K 1151.85 Joback Calculated Property
Cp,gas 1195.63 J/mol×K 1195.15 Joback Calculated Property
Cp,gas 1215.48 J/mol×K 1238.46 Joback Calculated Property
Cp,gas 1235.88 J/mol×K 1281.76 Joback Calculated Property
Cp,gas 1257.05 J/mol×K 1325.07 Joback Calculated Property
Cp,gas 1279.26 J/mol×K 1368.37 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. Ethylmorphine, trimethylsilyl ether. Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine. Ergocristine. Codeine-propionyl.

Find more compounds similar to Nicolaioidesin A.

Sources

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