ChemSpider 2D Image | Physalien | C72H116O4

Physalien

  • Molecular FormulaC72H116O4
  • Average mass1045.689 Da
  • Monoisotopic mass1044.887329 Da
  • ChemSpider ID4904574

  • Double-bond stereo - Double-bond stereo

More details:

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

Dihexadécanoate de β,β-carotène-3,3'-diyle [French] [ACD/IUPAC Name]
Hexadecanoic acid, β,β-carotene-3,3'-diyl ester [ACD/Index Name]
Physalien
β,β-Carotene-3,3'-diyl dihexadecanoate [ACD/IUPAC Name]
β,β-Carotin-3,3'-diyl-dihexadecanoat [German] [ACD/IUPAC Name]
144-67-2 [RN]
205-635-9 [EINECS]
4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[4-(hexadecanoyloxy)-2,6,6-trimethylcyclohex-1-en-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]-3,5,5-trimethylcyclohex-3-en-1-yl hexadecanoate
570944I2YB
physalin
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

C08609 [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: 956.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 139.4±3.0 kJ/mol
Flash Point: 462.1±32.7 °C
Index of Refraction: 1.524
Molar Refractivity: 332.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 42
#Rule of 5 Violations: 2
ACD/LogP: 28.33
ACD/LogD (pH 5.5): 26.92
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 26.92
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 53 Å2
Polarizability: 131.7±0.5 10-24cm3
Surface Tension: 39.8±5.0 dyne/cm
Molar Volume: 1086.5±5.0 cm3

Click to predict properties on the Chemicalize site


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