ChemSpider 2D Image | S-[(1S)-1-(4-Bromophenyl)-2-propen-1-yl] butylcarbamothioate | C14H18BrNOS

S-[(1S)-1-(4-Bromophenyl)-2-propen-1-yl] butylcarbamothioate

  • Molecular FormulaC14H18BrNOS
  • Average mass328.268 Da
  • Monoisotopic mass327.029236 Da
  • ChemSpider ID30659229

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Butylcarbamothioate de S-[(1S)-1-(4-bromophényl)-2-propén-1-yle] [French] [ACD/IUPAC Name]
Carbamothioic acid, N-butyl-, S-[(1S)-1-(4-bromophenyl)-2-propen-1-yl] ester [ACD/Index Name]
S-[(1S)-1-(4-Bromophenyl)-2-propen-1-yl] butylcarbamothioate [ACD/IUPAC Name]
S-[(1S)-1-(4-Bromphenyl)-2-propen-1-yl]-butylcarbamothioat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.566
Molar Refractivity: 82.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.09
ACD/LogD (pH 5.5): 4.20
ACD/BCF (pH 5.5): 913.03
ACD/KOC (pH 5.5): 4578.40
ACD/LogD (pH 7.4): 4.20
ACD/BCF (pH 7.4): 913.02
ACD/KOC (pH 7.4): 4578.38
Polar Surface Area: 54 Å2
Polarizability: 32.8±0.5 10-24cm3
Surface Tension: 41.9±3.0 dyne/cm
Molar Volume: 253.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement