ChemSpider 2D Image | (4R)-1-[(4-Bromophenyl)sulfonyl]-4-hydroxy-L-proline | C11H12BrNO5S

(4R)-1-[(4-Bromophenyl)sulfonyl]-4-hydroxy-L-proline

  • Molecular FormulaC11H12BrNO5S
  • Average mass350.186 Da
  • Monoisotopic mass348.961945 Da
  • ChemSpider ID43623687

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R)-1-[(4-Bromophenyl)sulfonyl]-4-hydroxy-L-proline [ACD/IUPAC Name]
(4R)-1-[(4-Bromophényl)sulfonyl]-4-hydroxy-L-proline [French] [ACD/IUPAC Name]
(4R)-1-[(4-Bromphenyl)sulfonyl]-4-hydroxy-L-prolin [German] [ACD/IUPAC Name]
L-Proline, 1-[(4-bromophenyl)sulfonyl]-4-hydroxy-, (4R)- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 554.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.9±3.0 kJ/mol
Flash Point: 289.0±32.9 °C
Index of Refraction: 1.664
Molar Refractivity: 71.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.93
ACD/LogD (pH 5.5): -1.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 103 Å2
Polarizability: 28.3±0.5 10-24cm3
Surface Tension: 75.1±3.0 dyne/cm
Molar Volume: 192.5±3.0 cm3

Click to predict properties on the Chemicalize site


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