ChemSpider 2D Image | 1,3-Dihydroxy-3,4a,8,8-tetramethyl-4-[(1E)-3-oxo-1-buten-1-yl]decahydro-2-naphthalenyl acetate | C20H32O5

1,3-Dihydroxy-3,4a,8,8-tetramethyl-4-[(1E)-3-oxo-1-buten-1-yl]decahydro-2-naphthalenyl acetate

  • Molecular FormulaC20H32O5
  • Average mass352.465 Da
  • Monoisotopic mass352.224976 Da
  • ChemSpider ID35013906

  • Double-bond stereo - Double-bond stereo

More details:

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

1,3-Dihydroxy-3,4a,8,8-tetramethyl-4-[(1E)-3-oxo-1-buten-1-yl]decahydro-2-naphthalenyl acetate [ACD/IUPAC Name]
1,3-Dihydroxy-3,4a,8,8-tetramethyl-4-[(1E)-3-oxo-1-buten-1-yl]decahydro-2-naphthalinyl-acetat [German] [ACD/IUPAC Name]
3-Buten-2-one, 4-[3-(acetyloxy)decahydro-2,4-dihydroxy-2,5,5,8a-tetramethyl-1-naphthalenyl]-, (3E)- [ACD/Index Name]
Acétate de 1,3-dihydroxy-3,4a,8,8-tétraméthyl-4-[(1E)-3-oxo-1-butén-1-yl]décahydro-2-naphtalényle [French] [ACD/IUPAC Name]
1,3-dihydroxy-3,4a,8,8-tetramethyl-4-[(1E)-3-oxobut-1-en-1-yl]-hexahydro-1H-naphthalen-2-yl acetate
Sterebin C

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

Density: 1.1±0.1 g/cm3
Boiling Point: 433.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 79.6±6.0 kJ/mol
Flash Point: 141.2±22.2 °C
Index of Refraction: 1.525
Molar Refractivity: 95.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.14
ACD/LogD (pH 5.5): 2.67
ACD/BCF (pH 5.5): 63.19
ACD/KOC (pH 5.5): 676.86
ACD/LogD (pH 7.4): 2.67
ACD/BCF (pH 7.4): 63.19
ACD/KOC (pH 7.4): 676.86
Polar Surface Area: 84 Å2
Polarizability: 37.8±0.5 10-24cm3
Surface Tension: 44.6±5.0 dyne/cm
Molar Volume: 311.7±5.0 cm3

Click to predict properties on the Chemicalize site


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