Chemical Properties of «alpha»-Tocospiro B (CAS 601490-41-9)

«alpha»-Tocospiro B

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InChI
InChI=1S/C29H50O4/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-17-27(8)18-19-28(33-27)26(31)23(5)24(6)29(28,32)25(7)30/h20-22,32H,9-19H2,1-8H3
InChI Key
NFNYYDIZCJKCQK-UHFFFAOYSA-N
Formula
C29H50O4
SMILES
CC(=O)C1(O)C(C)=C(C)C(=O)C12CCC(C)(CCCC(C)CCCC(C)CCCC(C)C)O2
Molecular Weight1
462.70
CAS
601490-41-9
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Physical Properties

Property Value Unit Source
Δf -216.75 kJ/mol Joback Calculated Property
Δfgas -1004.90 kJ/mol Joback Calculated Property
Δfus 46.06 kJ/mol Joback Calculated Property
Δvap 109.36 kJ/mol Joback Calculated Property
log10WS -8.13 Crippen Calculated Property
logPoct/wat 6.973 Crippen Calculated Property
McVol 408.330 ml/mol McGowan Calculated Property
Pc 888.94 kPa Joback Calculated Property
Inp [2881.70; 2881.70]   Show Hide
Inp 2881.70 NIST
Inp 2881.70 NIST
Tboil 1133.88 K Joback Calculated Property
Tc 1394.56 K Joback Calculated Property
Tfus 695.71 K Joback Calculated Property
Vc 1.563 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1637.03; 2008.74] J/mol×K [1133.88; 1394.56] Show Hide
Cp,gas 1637.03 J/mol×K 1133.88 Joback Calculated Property
Cp,gas 1687.54 J/mol×K 1177.33 Joback Calculated Property
Cp,gas 1741.87 J/mol×K 1220.77 Joback Calculated Property
Cp,gas 1800.60 J/mol×K 1264.22 Joback Calculated Property
Cp,gas 1864.28 J/mol×K 1307.67 Joback Calculated Property
Cp,gas 1933.47 J/mol×K 1351.11 Joback Calculated Property
Cp,gas 2008.74 J/mol×K 1394.56 Joback Calculated Property

Similar Compounds

«alpha»-Tocospiro A. Antheridic acid, MeTMS. Jacozine. Pumiline A. 1-Methyl-6«alpha»,7«alpha»-dihydroxyestrone, TMS. Axillarine. Yohimbine. Mucronatinine. Gelsemine. ethyl eburnamenine-14-carboxylate. Ibogaine. Nalmefene, bis(trifluoroacetate). Erucifoline (E). Veratraman-11-one, 17,23-epoxy-3-hydroxy-, (3«beta»,23«beta»)-. Senecicannabine.

Find more compounds similar to «alpha»-Tocospiro B.

Sources

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