Found 21 results

Search term: MF = 'C_{40}H_{50}'
ChemSpider 2D Image | (5S,6E)-3',4',11,11',12,12',15,15'-Octadehydro-5,8-dihydro-beta,beta-carotene | C40H50

(5S,6E)-3',4',11,11',12,12',15,15'-Octadehydro-5,8-dihydro-β,β-carotene

  • Molecular FormulaC40H50
  • Average mass530.825 Da
  • Monoisotopic mass530.391235 Da
  • ChemSpider ID61711567

  • Double-bond stereo - Double-bond stereo

More details:

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

(5S,6E)-3',4',11,11',12,12',15,15'-Octadehydro-5,8-dihydro-β,β-carotene [ACD/IUPAC Name]
(5S,6E)-3',4',11,11',12,12',15,15'-Octadéhydro-5,8-dihydro-β,β-carotène [French] [ACD/IUPAC Name]
(5S,6E)-3',4',11,11',12,12',15,15'-Octadehydro-5,8-dihydro-β,β-carotin [German] [ACD/IUPAC Name]
β,β-Carotene, 3,4,11,11',12,12',15,15'-octadehydro-5',8'-dihydro-, (5'S,6'E)- [ACD/Index Name]
BCR
β-Carotene [Wiki]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 612.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 87.6±0.8 kJ/mol
Flash Point: 333.0±25.6 °C
Index of Refraction: 1.578
Molar Refractivity: 179.6±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 16.73
ACD/LogD (pH 5.5): 13.17
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 13.17
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 0 Å2
Polarizability: 71.2±0.5 10-24cm3
Surface Tension: 41.2±3.0 dyne/cm
Molar Volume: 541.0±3.0 cm3

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