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Search term: FLYBTLROCQBHMR-KFSSTAEESA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 3-methyl-6-methoxy-2-octaprenyl-1,4-benzoquinone | C48H72O3

3-methyl-6-methoxy-2-octaprenyl-1,4-benzoquinone

  • Molecular FormulaC48H72O3
  • Average mass697.083 Da
  • Monoisotopic mass696.548157 Da
  • ChemSpider ID4444385

  • Double-bond stereo - Double-bond stereo

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2,5-Cyclohexadiene-1,4-dione, 5-methoxy-2-methyl-3-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaen-1-yl]- [ACD/Index Name]
3-methyl-6-methoxy-2-octaprenyl-1,4-benzoquinone
5-Methoxy-2-methyl-3-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaen-1-yl]-1,4-benzochinon [German] [ACD/IUPAC Name]
5-Methoxy-2-methyl-3-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaen-1-yl]-1,4-benzoquinone [ACD/IUPAC Name]
5-Méthoxy-2-méthyl-3-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octaméthyl-2,6,10,14,18,22,26,30-dotriacontaoctaén-1-yl]-1,4-benzoquinone [French] [ACD/IUPAC Name]
2-methyl-5-methoxy-3-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl]cyclohexa-2,5-diene-1,4-dione
2-Octaprenyl-3-methyl-6-methoxy-1,4-benzoquinone
3-methyl-6-methoxy-2-all-trans-octaprenyl-1,4-benzoquinone
5-METHOXY-2-METHYL-3-(3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA-2,6,10,14,18,22,26,30-OCTAEN-1-YL)CYCLOHEXA-2,5-DIENE-1,4-DIONE
5-methoxy-2-methyl-3-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl]cyclohexa-2,5-diene-1,4-dione
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

C05814 [DBID]
CHEBI:28636 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 751.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.5±3.0 kJ/mol
Flash Point: 292.4±32.9 °C
Index of Refraction: 1.525
Molar Refractivity: 220.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 2
ACD/LogP: 17.60
ACD/LogD (pH 5.5): 15.46
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 15.46
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 43 Å2
Polarizability: 87.5±0.5 10-24cm3
Surface Tension: 38.0±5.0 dyne/cm
Molar Volume: 720.7±5.0 cm3

Click to predict properties on the Chemicalize site


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