ChemSpider 2D Image | N-Acetyl-S-(3-bromo-2,5-dihydroxyphenyl)cysteine | C11H12BrNO5S

N-Acetyl-S-(3-bromo-2,5-dihydroxyphenyl)cysteine

  • Molecular FormulaC11H12BrNO5S
  • Average mass350.186 Da
  • Monoisotopic mass348.961945 Da
  • ChemSpider ID26502809

More details:

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

Cysteine, N-acetyl-S-(3-bromo-2,5-dihydroxyphenyl)- [ACD/Index Name]
N-Acetyl-S-(3-brom-2,5-dihydroxyphenyl)cystein [German] [ACD/IUPAC Name]
N-Acetyl-S-(3-bromo-2,5-dihydroxyphenyl)cysteine [ACD/IUPAC Name]
N-Acétyl-S-(3-bromo-2,5-dihydroxyphényl)cystéine [French] [ACD/IUPAC Name]
126190-03-2 [RN]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 586.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 92.1±3.0 kJ/mol
Flash Point: 308.5±30.1 °C
Index of Refraction: 1.693
Molar Refractivity: 74.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.06
ACD/LogD (pH 5.5): -1.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 132 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 87.7±5.0 dyne/cm
Molar Volume: 193.3±5.0 cm3

Click to predict properties on the Chemicalize site


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