Found 3158 results

Search term: MF = 'C_{12}H_{17}NO_{5}S'
ChemSpider 2D Image | Ethyl beta-hydroxy-4-(methylsulfonyl)phenylalaninate | C12H17NO5S

Ethyl β-hydroxy-4-(methylsulfonyl)phenylalaninate

  • Molecular FormulaC12H17NO5S
  • Average mass287.332 Da
  • Monoisotopic mass287.082733 Da
  • ChemSpider ID21112213

More details:

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

100483-39-4 [RN]
Ethyl β-hydroxy-4-(methylsulfonyl)phenylalaninate [ACD/IUPAC Name]
Ethyl-β-hydroxy-4-(methylsulfonyl)phenylalaninat [German] [ACD/IUPAC Name]
Phenylalanine, β-hydroxy-4-(methylsulfonyl)-, ethyl ester [ACD/Index Name]
β-Hydroxy-4-(méthylsulfonyl)phénylalaninate d'éthyle [French] [ACD/IUPAC Name]
β-Hydroxy-4-(methylsulfonyl)-phenylalanine ethyl ester
(2S)-Ethyl 2-amino-3-hydroxy-3-(4-(methylsulfonyl)phenyl)propanoate
(b-S)-
(b-S)-b-Hydroxy-4-(methylsulfonyl)-D-phenylalanine Ethyl Ester
??-HYDROXY-4-(METHYLSULFONYL)-PHENYLALANINE ETHYL ESTER
More...

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

Density: 1.3±0.1 g/cm3
Boiling Point: 515.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.8±3.0 kJ/mol
Flash Point: 265.2±30.1 °C
Index of Refraction: 1.554
Molar Refractivity: 70.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.52
ACD/LogD (pH 5.5): -1.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.58
ACD/LogD (pH 7.4): -0.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 13.24
Polar Surface Area: 115 Å2
Polarizability: 27.9±0.5 10-24cm3
Surface Tension: 52.4±3.0 dyne/cm
Molar Volume: 219.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement