ChemSpider 2D Image | 3-(5-Iodo-1,3-thiazol-2-yl)alanine | C6H7IN2O2S

3-(5-Iodo-1,3-thiazol-2-yl)alanine

  • Molecular FormulaC6H7IN2O2S
  • Average mass298.102 Da
  • Monoisotopic mass297.927277 Da
  • ChemSpider ID57288277

More details:

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

2-Thiazolepropanoic acid, α-amino-5-iodo- [ACD/Index Name]
3-(5-Iod-1,3-thiazol-2-yl)alanin [German] [ACD/IUPAC Name]
3-(5-Iodo-1,3-thiazol-2-yl)alanine [ACD/IUPAC Name]
3-(5-Iodo-1,3-thiazol-2-yl)alanine [French] [ACD/IUPAC Name]
1842594-87-9 [RN]
1867607-70-2 [RN]
D,L-ALA-3-[2-(5-IODO)THIAZOLE]

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

Density: 2.1±0.1 g/cm3
Boiling Point: 418.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 70.8±3.0 kJ/mol
Flash Point: 206.6±28.7 °C
Index of Refraction: 1.699
Molar Refractivity: 54.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.49
ACD/LogD (pH 5.5): -1.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 104 Å2
Polarizability: 21.8±0.5 10-24cm3
Surface Tension: 79.6±3.0 dyne/cm
Molar Volume: 142.2±3.0 cm3

Click to predict properties on the Chemicalize site


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