ChemSpider 2D Image | 2-(tert-Butoxymethyl)-4-(chloromethyl)thiazole | C9H14ClNOS

2-(tert-Butoxymethyl)-4-(chloromethyl)thiazole

  • Molecular FormulaC9H14ClNOS
  • Average mass219.732 Da
  • Monoisotopic mass219.048462 Da
  • ChemSpider ID38073527

More details:

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

1094334-53-8 [RN]
2-(tert-Butoxymethyl)-4-(chloromethyl)thiazole
4-(Chlormethyl)-2-{[(2-methyl-2-propanyl)oxy]methyl}-1,3-thiazol [German] [ACD/IUPAC Name]
4-(Chloromethyl)-2-{[(2-methyl-2-propanyl)oxy]methyl}-1,3-thiazole [ACD/IUPAC Name]
4-(Chlorométhyl)-2-{[(2-méthyl-2-propanyl)oxy]méthyl}-1,3-thiazole [French] [ACD/IUPAC Name]
Thiazole, 4-(chloromethyl)-2-[(1,1-dimethylethoxy)methyl]- [ACD/Index Name]
2-[(tert-butoxy)methyl]-4-(chloromethyl)-1,3-thiazole
MFCD11178259

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 282.8±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 50.1±3.0 kJ/mol
Flash Point: 124.8±23.2 °C
Index of Refraction: 1.523
Molar Refractivity: 57.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.44
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 58.04
ACD/KOC (pH 5.5): 636.97
ACD/LogD (pH 7.4): 2.62
ACD/BCF (pH 7.4): 58.05
ACD/KOC (pH 7.4): 636.97
Polar Surface Area: 50 Å2
Polarizability: 22.9±0.5 10-24cm3
Surface Tension: 38.8±3.0 dyne/cm
Molar Volume: 188.6±3.0 cm3

Click to predict properties on the Chemicalize site


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