ChemSpider 2D Image | 1-{2-[(4-Bromophenyl)sulfonyl]ethyl}-3-piperidinol | C13H18BrNO3S

1-{2-[(4-Bromophenyl)sulfonyl]ethyl}-3-piperidinol

  • Molecular FormulaC13H18BrNO3S
  • Average mass348.256 Da
  • Monoisotopic mass347.019073 Da
  • ChemSpider ID26055010

More details:

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

1-{2-[(4-Bromophenyl)sulfonyl]ethyl}-3-piperidinol [ACD/IUPAC Name]
1-{2-[(4-Bromophényl)sulfonyl]éthyl}-3-pipéridinol [French] [ACD/IUPAC Name]
1-{2-[(4-Bromphenyl)sulfonyl]ethyl}-3-piperidinol [German] [ACD/IUPAC Name]
3-Piperidinol, 1-[2-[(4-bromophenyl)sulfonyl]ethyl]- [ACD/Index Name]
1-[2-(4-bromobenzenesulfonyl)ethyl]piperidin-3-ol
1-{2-[(4-bromobenzene)sulfonyl]ethyl}piperidin-3-ol
1-{2-[(4-bromophenyl)sulfonyl]ethyl}piperidin-3-ol
1311314-89-2 [RN]
MFCD10728648

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

Density: 1.5±0.1 g/cm3
Boiling Point: 507.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.9±3.0 kJ/mol
Flash Point: 260.9±30.1 °C
Index of Refraction: 1.590
Molar Refractivity: 79.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.44
ACD/LogD (pH 5.5): -0.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.37
ACD/LogD (pH 7.4): 1.30
ACD/BCF (pH 7.4): 5.14
ACD/KOC (pH 7.4): 98.31
Polar Surface Area: 66 Å2
Polarizability: 31.3±0.5 10-24cm3
Surface Tension: 51.1±3.0 dyne/cm
Molar Volume: 234.4±3.0 cm3

Click to predict properties on the Chemicalize site


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