ChemSpider 2D Image | [1-(Bromomethyl)cyclopropyl]methyl 4-methylbenzenesulfonate | C12H15BrO3S

[1-(Bromomethyl)cyclopropyl]methyl 4-methylbenzenesulfonate

  • Molecular FormulaC12H15BrO3S
  • Average mass319.215 Da
  • Monoisotopic mass317.992523 Da
  • ChemSpider ID29775727

More details:

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

[1-(Brommethyl)cyclopropyl]methyl-4-methylbenzolsulfonat [German] [ACD/IUPAC Name]
[1-(Bromomethyl)cyclopropyl]methyl 4-methylbenzenesulfonate [ACD/IUPAC Name]
4-Méthylbenzènesulfonate de [1-(bromométhyl)cyclopropyl]méthyle [French] [ACD/IUPAC Name]
Cyclopropanemethanol, 1-(bromomethyl)-, 4-methylbenzenesulfonate [ACD/Index Name]
[1-(Bromomethyl)cyclopropyl]methyl p-methylbenzenesulfonate
1427504-53-7 [RN]
MFCD23703848

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

Density: 1.5±0.1 g/cm3
Boiling Point: 414.4±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.1±3.0 kJ/mol
Flash Point: 204.4±21.2 °C
Index of Refraction: 1.570
Molar Refractivity: 70.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.81
ACD/LogD (pH 5.5): 3.09
ACD/BCF (pH 5.5): 130.72
ACD/KOC (pH 5.5): 1138.89
ACD/LogD (pH 7.4): 3.09
ACD/BCF (pH 7.4): 130.72
ACD/KOC (pH 7.4): 1138.89
Polar Surface Area: 52 Å2
Polarizability: 28.1±0.5 10-24cm3
Surface Tension: 46.0±3.0 dyne/cm
Molar Volume: 215.8±3.0 cm3

Click to predict properties on the Chemicalize site


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