Found 17 results

Search term: MF = 'C_{13}H_{11}NO_{2}S_{3}'
ChemSpider 2D Image | 4-(1-Benzothiophen-3-yl)-2-[(methylsulfonyl)methyl]-1,3-thiazole | C13H11NO2S3

4-(1-Benzothiophen-3-yl)-2-[(methylsulfonyl)methyl]-1,3-thiazole

  • Molecular FormulaC13H11NO2S3
  • Average mass309.427 Da
  • Monoisotopic mass308.995178 Da
  • ChemSpider ID65291906

More details:

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

4-(1-Benzothiophen-3-yl)-2-[(methylsulfonyl)methyl]-1,3-thiazol [German] [ACD/IUPAC Name]
4-(1-Benzothiophen-3-yl)-2-[(methylsulfonyl)methyl]-1,3-thiazole [ACD/IUPAC Name]
4-(1-Benzothiophén-3-yl)-2-[(méthylsulfonyl)méthyl]-1,3-thiazole [French] [ACD/IUPAC Name]
Thiazole, 4-benzo[b]thien-3-yl-2-[(methylsulfonyl)methyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 571.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.4±3.0 kJ/mol
Flash Point: 299.1±27.3 °C
Index of Refraction: 1.680
Molar Refractivity: 81.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.08
ACD/LogD (pH 5.5): 3.25
ACD/BCF (pH 5.5): 172.68
ACD/KOC (pH 5.5): 1390.03
ACD/LogD (pH 7.4): 3.25
ACD/BCF (pH 7.4): 172.69
ACD/KOC (pH 7.4): 1390.09
Polar Surface Area: 112 Å2
Polarizability: 32.2±0.5 10-24cm3
Surface Tension: 62.7±3.0 dyne/cm
Molar Volume: 214.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement