ChemSpider 2D Image | 2,7,8-Trimethyl-2-[(3E,7E,11E,15E,19E,23Z,27E)-4,8,12,16,20,24,28,32-octamethyl-3,7,11,15,19,23,27,31-tritriacontaoctaen-1-yl]-2H-chromen-6-ol | C53H80O2

2,7,8-Trimethyl-2-[(3E,7E,11E,15E,19E,23Z,27E)-4,8,12,16,20,24,28,32-octamethyl-3,7,11,15,19,23,27,31-tritriacontaoctaen-1-yl]-2H-chromen-6-ol

  • Molecular FormulaC53H80O2
  • Average mass749.201 Da
  • Monoisotopic mass748.615845 Da
  • ChemSpider ID8254316

  • Double-bond stereo - Double-bond stereo

More details:

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

2,7,8-Trimethyl-2-[(3E,7E,11E,15E,19E,23Z,27E)-4,8,12,16,20,24,28,32-octamethyl-3,7,11,15,19,23,27,31-tritriacontaoctaen-1-yl]-2H-chromen-6-ol [ACD/IUPAC Name]
2,7,8-Trimethyl-2-[(3E,7E,11E,15E,19E,23Z,27E)-4,8,12,16,20,24,28,32-octamethyl-3,7,11,15,19,23,27,31-tritriacontaoctaen-1-yl]-2H-chromen-6-ol [German] [ACD/IUPAC Name]
2,7,8-Triméthyl-2-[(3E,7E,11E,15E,19E,23Z,27E)-4,8,12,16,20,24,28,32-octaméthyl-3,7,11,15,19,23,27,31-tritriacontaoctaén-1-yl]-2H-chromén-6-ol [French] [ACD/IUPAC Name]
2H-1-Benzopyran-6-ol, 2,7,8-trimethyl-2-[(3E,7E,11E,15E,19E,23Z,27E)-4,8,12,16,20,24,28,32-octamethyl-3,7,11,15,19,23,27,31-tritriacontaoctaen-1-yl]- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 782.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 117.8±3.0 kJ/mol
Flash Point: 320.2±27.1 °C
Index of Refraction: 1.526
Molar Refractivity: 245.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 2
ACD/LogP: 20.58
ACD/LogD (pH 5.5): 18.28
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 18.28
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 29 Å2
Polarizability: 97.1±0.5 10-24cm3
Surface Tension: 35.3±3.0 dyne/cm
Molar Volume: 798.7±3.0 cm3

Click to predict properties on the Chemicalize site


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