ChemSpider 2D Image | (2S)-2,7,8-Trimethyl-5-(~14~C)methyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-yl acetate | C3014CH52O3

(2S)-2,7,8-Trimethyl-5-(14C)methyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-yl acetate

  • Molecular FormulaC3014CH52O3
  • Average mass474.735 Da
  • Monoisotopic mass474.394897 Da
  • ChemSpider ID8727885
  • defined stereocentres - 3 of 3 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(2S)-2,7,8-Trimethyl-5-(14C)methyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-yl acetate [ACD/IUPAC Name]
(2S)-2,7,8-Trimethyl-5-(14C)methyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-yl-acetat [German] [ACD/IUPAC Name]
2H-1-Benzopyran-6-ol, 3,4-dihydro-2,7,8-trimethyl-5-(methyl-14C)-2-[(4R,8R)-4,8,12-trimethyltridecyl]-, acetate, (2S)- [ACD/Index Name]
Acétate de (2S)-2,7,8-triméthyl-5-(14C)méthyl-2-[(4R,8R)-4,8,12-triméthyltridécyl]-3,4-dihydro-2H-chromén-6-yle [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.488
Molar Refractivity: 144.5±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 57.3±0.5 10-24cm3
Surface Tension: 33.7±3.0 dyne/cm
Molar Volume: 502.0±3.0 cm3

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