ChemSpider 2D Image | (11cis,13cis)-7,7',8,8'-Tetradehydro-beta,beta-carotene-3,3'-diol | C40H52O2

(11cis,13cis)-7,7',8,8'-Tetradehydro-β,β-carotene-3,3'-diol

  • Molecular FormulaC40H52O2
  • Average mass564.840 Da
  • Monoisotopic mass564.396729 Da
  • ChemSpider ID4475366

  • Double-bond stereo - Double-bond stereo

More details:

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

(11cis,13cis)-7,7',8,8'-Tetradehydro-β,β-carotene-3,3'-diol [ACD/IUPAC Name]
(11cis,13cis)-7,7',8,8'-Tétradéhydro-β,β-carotène-3,3'-diol [French] [ACD/IUPAC Name]
(11cis,13cis)-7,7',8,8'-Tetradehydro-β,β-carotin-3,3'-diol [German] [ACD/IUPAC Name]
β,β-Carotene-3,3'-diol, 7,7',8,8'-tetradehydro-, (11cis,13cis)- [ACD/Index Name]
Cynthiaxanthin

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

Density: 1.0±0.1 g/cm3
Boiling Point: 705.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 117.9±6.0 kJ/mol
Flash Point: 272.4±27.5 °C
Index of Refraction: 1.574
Molar Refractivity: 179.6±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 12.18
ACD/LogD (pH 5.5): 10.53
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.53
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 40 Å2
Polarizability: 71.2±0.5 10-24cm3
Surface Tension: 44.9±5.0 dyne/cm
Molar Volume: 544.5±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement