Chemical Properties of Ubidecarenone (CAS 303-98-0)

Ubidecarenone

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InChI
InChI=1S/C59H90O4/c1-44(2)24-15-25-45(3)26-16-27-46(4)28-17-29-47(5)30-18-31-48(6)32-19-33-49(7)34-20-35-50(8)36-21-37-51(9)38-22-39-52(10)40-23-41-53(11)42-43-55-54(12)56(60)58(62-13)59(63-14)57(55)61/h24,26,28,30,32,34,36,38,40,42H,15-23,25,27,29,31,33,35,37,39,41,43H2,1-14H3/b45-26+,46-28+,47-30+,48-32+,49-34+,50-36+,51-38+,52-40+,53-42+
InChI Key
ACTIUHUUMQJHFO-UPTCCGCDSA-N
Formula
C59H90O4
SMILES
COC1=C(OC)C(=O)C(CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C)=C(C)C1=O
Molecular Weight1
863.34
CAS
303-98-0
Other Names
  • (all-E)-2-(3,7,11,15,19,23,27,31,35,39-Decamethyl-2,6,10,14,18,22,26,30,34,38-tetracontadecaenyl)-5,6-dimethoxy-3-methyl-2,5-cyclohexadiene-1,4-dione
  • 2,5-Cyclohexadiene-1,4-dione, 2-(3,7,11,15,19,23,27,31,35,39-decamethyl-2,6,10,14,18,22,26,30,34,38-tetracontadecaenyl)-5,6-dimethoxy-3-methyl-, (all trans)-
  • 2,5-Cyclohexadiene-1,4-dione, 2-(3,7,11,15,19,23,27,31,35,39-decamethyl-2,6,10,14,18,22,26,30,34,38-tetracontadecaenyl)-5,6-dimethoxy-3-methyl-, (all-E)-
  • 2-((all-E)-3,7,11,15,19,23,27,31,35,39-Decamethyl-2,6,10,14,18,22,26,30,34,38-tetracontadecaenyl)-5,6-dimethoxy-3-methyl-2,5-cyclohexadiene-1,4-dione
  • 2-(3,7,11,15,19,23,27,31,35,39-Decamethyl-2,6,10,14,18,22,26,30,34,38-tetracontadecaenyl)-5,6-dimethoxy-3-methyl-p-benzoquinone, (all trans)-
  • 2-[(2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,-35,39-decamethyl-2,6,10,14,18,22,26,30,34,38-tetracontadecaen-1-yl]-5,6-dimethoxy-3-methyl-2,5-cyclohexadiene-1,4-dione (Ubidecarenone)
  • CoQ10
  • Coenzyme Q10
  • Emitolon
  • Heartcin
  • Inokiten
  • Justquinon
  • NSC 140865
  • Neuquinon
  • Neuquinone
  • Q 10AA
  • Q 199
  • Terekol
  • Ube-Q
  • Ubiquinone 50
  • Ubiquinone Q10
  • Udekinon
  • p-Benzoquinone, 2-(3,7,11,15,19,23,27,31,35,39-decamethyl-2,6,10,14,18,22,26,30,34,38-tetracontadecaenyl)-5,6-dimethoxy-3-methyl-
  • ubiquinone
  • ubiquinone 10
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Physical Properties

Property Value Unit Source
Δf 760.98 kJ/mol Joback Calculated Property
Δfgas -582.29 kJ/mol Joback Calculated Property
Δfus 82.00 kJ/mol Binary ...
Δvap 164.59 kJ/mol Joback Calculated Property
log10WS -20.38 Crippen Calculated Property
logPoct/wat 17.854 Crippen Calculated Property
McVol 794.590 ml/mol McGowan Calculated Property
Pc 275.39 kPa Joback Calculated Property
Tboil 1812.66 K Joback Calculated Property
Tc 3030.41 K Joback Calculated Property
Tfus 808.41 K Joback Calculated Property
Vc 3.106 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [3540.42; 8417.35] J/mol×K [1812.66; 3030.41] Show Hide
Cp,gas 3540.42 J/mol×K 1812.66 Joback Calculated Property
Cp,gas 3886.64 J/mol×K 2015.62 Joback Calculated Property
Cp,gas 4366.40 J/mol×K 2218.58 Joback Calculated Property
Cp,gas 5019.52 J/mol×K 2421.54 Joback Calculated Property
Cp,gas 5885.84 J/mol×K 2624.49 Joback Calculated Property
Cp,gas 7005.18 J/mol×K 2827.45 Joback Calculated Property
Cp,gas 8417.35 J/mol×K 3030.41 Joback Calculated Property
ΔfusH 82.00 kJ/mol 322.50 NIST

Similar Compounds

Plastoquinone 3. trans-Dehydrohumulinic acid, TMS. Senkyunone. Cyclothiazide. Floricaline (otonecine-diacetyljacoline). Desacetyldoronine (otonecin-jaconine). trans-2,3-Tetralinediol, ferrocenylboronate. (-)-2-Aminobutan-1-ol, ferroceneboronate derivative. pimaricin. Consabatine. 3'-acetylsupinine. 3'-acetylindicine. 4,8-Secosenecionan-8,11,16-trione, 15,20-dihydro-12-(acetyloxy)-20-chloro-15-hydroxy-4-methyl-. Doronine (otonecine-acetyljaconine). 4'-Dihydroconsabatine.

Find more compounds similar to Ubidecarenone.

Mixtures

Sources

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