Chemical Properties of Tocol, 5,8-dimethyl

Tocol, 5,8-dimethyl

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InChI
InChI=1S/C28H48O2/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-17-28(7)18-16-25-24(6)26(29)19-23(5)27(25)30-28/h19-22,29H,8-18H2,1-7H3/t21-,22-,28-/m0/s1
InChI Key
WGVKWNUPNGFDFJ-VPYPWEPUSA-N
Formula
C28H48O2
SMILES
Cc1cc(O)c(C)c2c1OC(C)(CCCC(C)CCCC(C)CCCC(C)C)CC2
Molecular Weight1
416.68
Sources

Physical Properties

Property Value Unit Source
Δf 63.50 kJ/mol Joback Calculated Property
Δfgas -662.40 kJ/mol Joback Calculated Property
Δfus 54.08 kJ/mol Joback Calculated Property
Δvap 97.48 kJ/mol Joback Calculated Property
logPoct/wat 8.53 Crippen Calculated Property
Pc 943.26 kPa Joback Calculated Property
Tboil 999.16 K Joback Calculated Property
Tc 1224.33 K Joback Calculated Property
Tfus 600.91 K Joback Calculated Property
Vc 1.41 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1368.02 J/mol×K 999.16 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 3
-O- (ring) 1
=CH- (ring) 1
=C< (ring) 5
-CH2- 9
>C< (ring) 1
-CH3 7
-OH (phenol) 1
-CH2- (ring) 2

Similar Compounds

«beta»-Tocopherol. dl-«alpha»-Tocopherol. d,«alpha»-Tocopherol. Vitamin E. «beta»-Tocopherol, O-methyl-. (R)-6-Methoxy-2,5,7,8-tetramethyl-2-((4R,8R)-4,8,12-trimethyltridecyl)chroman. Tocol, 5,7-dimethyl. Tocol, 7,8-dimethyl. «gamma»-Tocopherol. Tocol, 5-methyl. 6-Methoxy-2,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)chroman. (+)-«gamma»-Tocopherol, O-methyl-. «beta»-Tocopherol, O-acetyl-. «alpha»-Tocopheryl acetate. (.+/-.)-«alpha»-Tocopherol acetate.

Find more compounds similar to Tocol, 5,8-dimethyl.

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