ChemSpider 2D Image | (3E)-4-[(1R)-2,2-Dimethylcyclobutyl]-3-buten-2-one | C10H16O

(3E)-4-[(1R)-2,2-Dimethylcyclobutyl]-3-buten-2-one

  • Molecular FormulaC10H16O
  • Average mass152.233 Da
  • Monoisotopic mass152.120117 Da
  • ChemSpider ID28284816

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

Featured data source
Natural Product Updates

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

(3E)-4-[(1R)-2,2-Dimethylcyclobutyl]-3-buten-2-on [German] [ACD/IUPAC Name]
(3E)-4-[(1R)-2,2-Dimethylcyclobutyl]-3-buten-2-one [ACD/IUPAC Name]
(3E)-4-[(1R)-2,2-Diméthylcyclobutyl]-3-butén-2-one [French] [ACD/IUPAC Name]
3-Buten-2-one, 4-[(1R)-2,2-dimethylcyclobutyl]-, (3E)- [ACD/Index Name]
(+)-(R)-junionone

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

Density: 1.0±0.1 g/cm3
Boiling Point: 210.2±9.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.7±3.0 kJ/mol
Flash Point: 78.7±11.9 °C
Index of Refraction: 1.518
Molar Refractivity: 48.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.53
ACD/LogD (pH 5.5): 2.35
ACD/BCF (pH 5.5): 36.14
ACD/KOC (pH 5.5): 453.72
ACD/LogD (pH 7.4): 2.35
ACD/BCF (pH 7.4): 36.14
ACD/KOC (pH 7.4): 453.72
Polar Surface Area: 17 Å2
Polarizability: 19.1±0.5 10-24cm3
Surface Tension: 33.0±3.0 dyne/cm
Molar Volume: 158.9±3.0 cm3

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