ChemSpider 2D Image | ?-methyldopa-3-0-sulfate | C10H13NO7S

?-methyldopa-3-0-sulfate

  • Molecular FormulaC10H13NO7S
  • Average mass291.278 Da
  • Monoisotopic mass291.041260 Da
  • ChemSpider ID52084138

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

?-methyldopa-3-0-sulfate
72572-96-4 [RN]
L-Tyrosine, α-methyl-3-(sulfooxy)- [ACD/Index Name]
α-Methyl-3-(sulfooxy)-L-tyrosin [German] [ACD/IUPAC Name]
α-Methyl-3-(sulfooxy)-L-tyrosine [ACD/IUPAC Name]
α-Méthyl-3-(sulfooxy)-L-tyrosine [French] [ACD/IUPAC Name]
(2S)-2-amino-3-[4-hydroxy-3-(sulfooxy)phenyl]-2-methylpropanoic acid
α-Methyldopa-3-0-sulfate
α-METHYLDOPA-3-0-SULFATE

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

YZE76Y06KC [DBID]
UNII:YZE76Y06KC [DBID]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.640
Molar Refractivity: 64.2±0.4 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -0.40
ACD/LogD (pH 5.5): -4.89
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.96
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 156 Å2
Polarizability: 25.4±0.5 10-24cm3
Surface Tension: 85.3±3.0 dyne/cm
Molar Volume: 178.1±3.0 cm3

Click to predict properties on the Chemicalize site


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