ChemSpider 2D Image | O-Benzylsulfonyl-Serine | C10H13NO5S

O-Benzylsulfonyl-Serine

  • Molecular FormulaC10H13NO5S
  • Average mass259.279 Da
  • Monoisotopic mass259.051453 Da
  • ChemSpider ID16744196

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Serine, O-[(phenylmethyl)sulfonyl]- [ACD/Index Name]
O-(Benzylsulfonyl)-L-serin [German] [ACD/IUPAC Name]
O-(Benzylsulfonyl)-L-serine [ACD/IUPAC Name]
O-(Benzylsulfonyl)-L-sérine [French] [ACD/IUPAC Name]
O-Benzylsulfonyl-Serine
(2S)-2-amino-3-(phenylmethanesulfonyloxy)propanoic acid
(2S)-2-amino-3-[(phenylmethane)sulfonyloxy]propanoic acid
(R)-RETRO-THIORPHAN

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

RRT [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 516.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.0±3.0 kJ/mol
Flash Point: 266.3±30.1 °C
Index of Refraction: 1.589
Molar Refractivity: 61.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.94
ACD/LogD (pH 5.5): -2.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 115 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 64.8±3.0 dyne/cm
Molar Volume: 181.3±3.0 cm3

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