ChemSpider 2D Image | 1-{[2-(Allyloxy)-1-bromoethyl]sulfonyl}-4-methylbenzene | C12H15BrO3S

1-{[2-(Allyloxy)-1-bromoethyl]sulfonyl}-4-methylbenzene

  • Molecular FormulaC12H15BrO3S
  • Average mass319.215 Da
  • Monoisotopic mass317.992523 Da
  • ChemSpider ID28701586

More details:

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

1-{[2-(Allyloxy)-1-bromethyl]sulfonyl}-4-methylbenzol [German] [ACD/IUPAC Name]
1-{[2-(Allyloxy)-1-bromoethyl]sulfonyl}-4-methylbenzene [ACD/IUPAC Name]
1-{[2-(Allyloxy)-1-bromoéthyl]sulfonyl}-4-méthylbenzène [French] [ACD/IUPAC Name]
Benzene, 1-[[1-bromo-2-(2-propen-1-yloxy)ethyl]sulfonyl]-4-methyl- [ACD/Index Name]
1-{1-Bromo-2-[(prop-2-en-1-yl)oxy]ethanesulfonyl}-4-methylbenzene
89478-87-5 [RN]
BENZENE, 1-[[1-BROMO-2-(2-PROPENYLOXY)ETHYL]SULFONYL]-4-METHYL-

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

Density: 1.4±0.1 g/cm3
Boiling Point: 433.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.2±3.0 kJ/mol
Flash Point: 215.8±28.7 °C
Index of Refraction: 1.548
Molar Refractivity: 72.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.49
ACD/LogD (pH 5.5): 2.88
ACD/BCF (pH 5.5): 90.42
ACD/KOC (pH 5.5): 874.78
ACD/LogD (pH 7.4): 2.88
ACD/BCF (pH 7.4): 90.42
ACD/KOC (pH 7.4): 874.78
Polar Surface Area: 52 Å2
Polarizability: 28.8±0.5 10-24cm3
Surface Tension: 42.1±3.0 dyne/cm
Molar Volume: 228.5±3.0 cm3

Click to predict properties on the Chemicalize site


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