ChemSpider 2D Image | b-Carotenone | C40H56O4

b-Carotenone

  • Molecular FormulaC40H56O4
  • Average mass600.870 Da
  • Monoisotopic mass600.417847 Da
  • ChemSpider ID16736356

  • Double-bond stereo - Double-bond stereo

More details:

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

(8E,10E,12E,14E,16E,18E,20E,22E,24E)-6,6,10,14,19,23,27,27-Octamethyl-8,10,12,14,16,18,20,22,24-dotriacontanonaen-2,7,26,31-tetron [German] [ACD/IUPAC Name]
(8E,10E,12E,14E,16E,18E,20E,22E,24E)-6,6,10,14,19,23,27,27-Octamethyl-8,10,12,14,16,18,20,22,24-dotriacontanonaene-2,7,26,31-tetrone [ACD/IUPAC Name]
(8E,10E,12E,14E,16E,18E,20E,22E,24E)-6,6,10,14,19,23,27,27-Octaméthyl-8,10,12,14,16,18,20,22,24-dotriacontanonaène-2,7,26,31-tétrone [French] [ACD/IUPAC Name]
(8E,10E,12E,14E,16E,18E,20E,22E,24E)-6,6,10,14,19,23,27,27-octamethyldotriaconta-8,10,12,14,16,18,20,22,24-nonaene-2,7,26,31-tetrone
20126-74-3 [RN]
5,6:5',6'-Diseco-b,b-carotene-5,6,5',6'-tetrone
8,10,12,14,16,18,20,22,24-Dotriacontanonaene-2,7,26,31-tetrone, 6,6,10,14,19,23,27,27-octamethyl-, (8E,10E,12E,14E,16E,18E,20E,22E,24E)- [ACD/Index Name]
b-Carotenone
5,6,5',6'-Diseco-β,β-carotene-5,6,5',6'-tetrone
β-Carotenone

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

Density: 1.0±0.1 g/cm3
Boiling Point: 755.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.0±3.0 kJ/mol
Flash Point: 344.4±14.4 °C
Index of Refraction: 1.517
Molar Refractivity: 187.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 2
ACD/LogP: 7.63
ACD/LogD (pH 5.5): 7.23
ACD/BCF (pH 5.5): 182785.77
ACD/KOC (pH 5.5): 203270.56
ACD/LogD (pH 7.4): 7.23
ACD/BCF (pH 7.4): 182785.77
ACD/KOC (pH 7.4): 203270.56
Polar Surface Area: 68 Å2
Polarizability: 74.3±0.5 10-24cm3
Surface Tension: 34.8±3.0 dyne/cm
Molar Volume: 619.1±3.0 cm3

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