ChemSpider 2D Image | Yingzhaosu D | C15H26O3

Yingzhaosu D

  • Molecular FormulaC15H26O3
  • Average mass254.365 Da
  • Monoisotopic mass254.188202 Da
  • ChemSpider ID32699722
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres


More details:






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

(3R,4E,6R)-2-Methyl-6-[(1S)-4-methyl-3-cyclohexen-1-yl]-4-hepten-2,3,6-triol [German] [ACD/IUPAC Name]
(3R,4E,6R)-2-Methyl-6-[(1S)-4-methyl-3-cyclohexen-1-yl]-4-heptene-2,3,6-triol [ACD/IUPAC Name]
(3R,4E,6R)-2-Méthyl-6-[(1S)-4-méthyl-3-cyclohexén-1-yl]-4-heptène-2,3,6-triol [French] [ACD/IUPAC Name]
121067-53-6 [RN]
4-Heptene-2,3,6-triol, 2-methyl-6-[(1S)-4-methyl-3-cyclohexen-1-yl]-, (3R,4E,6R)- [ACD/Index Name]
Yingzhaosu D

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

H2YF6RT7WP [DBID]
UNII:H2YF6RT7WP [DBID]
UNII-H2YF6RT7WP [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 420.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 77.9±6.0 kJ/mol
Flash Point: 195.4±21.9 °C
Index of Refraction: 1.532
Molar Refractivity: 73.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.87
ACD/LogD (pH 5.5): 2.12
ACD/BCF (pH 5.5): 23.96
ACD/KOC (pH 5.5): 338.14
ACD/LogD (pH 7.4): 2.12
ACD/BCF (pH 7.4): 23.96
ACD/KOC (pH 7.4): 338.14
Polar Surface Area: 61 Å2
Polarizability: 29.1±0.5 10-24cm3
Surface Tension: 44.9±3.0 dyne/cm
Molar Volume: 236.6±3.0 cm3

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