Chemical Properties of «beta»-Tocopherol, O-methyl-

«beta»-Tocopherol, O-methyl-

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InChI
InChI=1S/C29H50O2/c1-21(2)12-9-13-22(3)14-10-15-23(4)16-11-18-29(7)19-17-26-25(6)27(30-8)20-24(5)28(26)31-29/h20-23H,9-19H2,1-8H3
InChI Key
AGSJHGZIOXTYIA-UHFFFAOYSA-N
Formula
C29H50O2
SMILES
COc1cc(C)c2c(c1C)CCC(C)(CCCC(C)CCCC(C)CCCC(C)C)O2
Molecular Weight1
430.71
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Physical Properties

Property Value Unit Source
Δf 111.91 kJ/mol Joback Calculated Property
Δfgas -649.42 kJ/mol Joback Calculated Property
Δfus 51.69 kJ/mol Joback Calculated Property
Δvap 89.76 kJ/mol Joback Calculated Property
log10WS -9.86 Crippen Calculated Property
logPoct/wat 8.835 Crippen Calculated Property
McVol 396.590 ml/mol McGowan Calculated Property
Pc 801.15 kPa Joback Calculated Property
Inp [2960.00; 2960.00]   Show Hide
Inp 2960.00 NIST
Inp 2960.00 NIST
Tboil 968.82 K Joback Calculated Property
Tc 1186.68 K Joback Calculated Property
Tfus 535.21 K Joback Calculated Property
Vc 1.520 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1391.28; 1539.41] J/mol×K [968.82; 1186.68] Show Hide
Cp,gas 1391.28 J/mol×K 968.82 Joback Calculated Property
Cp,gas 1416.83 J/mol×K 1005.13 Joback Calculated Property
Cp,gas 1441.82 J/mol×K 1041.44 Joback Calculated Property
Cp,gas 1466.42 J/mol×K 1077.75 Joback Calculated Property
Cp,gas 1490.77 J/mol×K 1114.06 Joback Calculated Property
Cp,gas 1515.05 J/mol×K 1150.37 Joback Calculated Property
Cp,gas 1539.41 J/mol×K 1186.68 Joback Calculated Property

Similar Compounds

6-Methoxy-2,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)chroman. Tocol, 5,8-dimethyl. «beta»-Tocopherol. «beta»-Tocopherol, O-acetyl-. «beta»-Tocopherol, O-trifluoroacetyl-. Tocopherol-«beta»-tms-derivative (high mass adjustment=0 %). (R)-6-Methoxy-2,5,7,8-tetramethyl-2-((4R,8R)-4,8,12-trimethyltridecyl)chroman. «beta»-Tocopherol, O-pentafluoropropionyl-. «beta»-Tocopherol, O-heptafluorobutyryl-. Tocol, 7,8-dimethyl. «gamma»-Tocopherol. (+)-«gamma»-Tocophero, O-trifluoroacetyl-. (+)-«gamma»-Tocopherol, O-acetyl-. «delta»-Tocopherol, O-methyl-. (R)-6-Methoxy-2,8-dimethyl-2-((4R,8R)-4,8,12-trimethyltridecyl)chroman.

Find more compounds similar to «beta»-Tocopherol, O-methyl-.

Sources

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