Found 1 result

Search term: LEZWWRFRLBRKIY (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-Cyclopropyl-3,3-bis(methylsulfanyl)-2-propen-1-one | C8H12OS2

1-Cyclopropyl-3,3-bis(methylsulfanyl)-2-propen-1-one

  • Molecular FormulaC8H12OS2
  • Average mass188.310 Da
  • Monoisotopic mass188.032959 Da
  • ChemSpider ID32838740

More details:

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

1-Cyclopropyl-3,3-bis(methylsulfanyl)-2-propen-1-on [German] [ACD/IUPAC Name]
1-Cyclopropyl-3,3-bis(methylsulfanyl)-2-propen-1-one [ACD/IUPAC Name]
1-Cyclopropyl-3,3-bis(méthylsulfanyl)-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 1-cyclopropyl-3,3-bis(methylthio)- [ACD/Index Name]
1185281-16-6 [RN]
1-Cyclopropyl-3,3-bis-methylsulfanyl-propenone
MFCD23695391

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

Density: 1.2±0.1 g/cm3
Boiling Point: 315.1±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.6±3.0 kJ/mol
Flash Point: 137.7±16.6 °C
Index of Refraction: 1.596
Molar Refractivity: 52.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.38
ACD/LogD (pH 5.5): 2.11
ACD/BCF (pH 5.5): 23.74
ACD/KOC (pH 5.5): 335.88
ACD/LogD (pH 7.4): 2.11
ACD/BCF (pH 7.4): 23.74
ACD/KOC (pH 7.4): 335.88
Polar Surface Area: 68 Å2
Polarizability: 20.9±0.5 10-24cm3
Surface Tension: 49.8±3.0 dyne/cm
Molar Volume: 155.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement