ChemSpider 2D Image | epsilon-carotene | C40H56

ε-carotene

  • Molecular FormulaC40H56
  • Average mass536.873 Da
  • Monoisotopic mass536.438232 Da
  • ChemSpider ID393790

  • Double-bond stereo - Double-bond stereo

More details:

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

38894-81-4 [RN]
4,4'-Didehydro-6,6'-dihydro-β,β-carotene [ACD/IUPAC Name]
4,4'-Didéhydro-6,6'-dihydro-β,β-carotène [French] [ACD/IUPAC Name]
4,4'-Didehydro-6,6'-dihydro-β,β-carotin [German] [ACD/IUPAC Name]
β,β-Carotene, 4,4'-didehydro-6,6'-dihydro- [ACD/Index Name]
ε-carotene
ε-CAROTENE, (6R,6'R)-
ε-CAROTENE, (6S,6'S)-
&ε;,&ε;-carotene
1,5,5-trimethyl-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohex-2-en-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]cyclohex-1-ene
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

632758C52E [DBID]
CHEBI:32549 [DBID]
V162M4E35G [DBID]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 635.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 90.5±0.8 kJ/mol
Flash Point: 336.4±26.3 °C
Index of Refraction: 1.561
Molar Refractivity: 185.9±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 15.39
ACD/LogD (pH 5.5): 12.90
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 12.90
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 0 Å2
Polarizability: 73.7±0.5 10-24cm3
Surface Tension: 35.7±3.0 dyne/cm
Molar Volume: 574.1±3.0 cm3

Click to predict properties on the Chemicalize site


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