Found 364 results

Search term: MF = 'C_{14}H_{18}N_{2}O_{2}S_{3}'
ChemSpider 2D Image | 1-(2-Thienylmethyl)-4-(2-thienylsulfonyl)-1,4-diazepane | C14H18N2O2S3

1-(2-Thienylmethyl)-4-(2-thienylsulfonyl)-1,4-diazepane

  • Molecular FormulaC14H18N2O2S3
  • Average mass342.500 Da
  • Monoisotopic mass342.053040 Da
  • ChemSpider ID30143856

More details:

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

1-(2-Thienylmethyl)-4-(2-thienylsulfonyl)-1,4-diazepan [German] [ACD/IUPAC Name]
1-(2-Thienylmethyl)-4-(2-thienylsulfonyl)-1,4-diazepane [ACD/IUPAC Name]
1-(2-Thiénylméthyl)-4-(2-thiénylsulfonyl)-1,4-diazépane [French] [ACD/IUPAC Name]
1H-1,4-Diazepine, hexahydro-1-(2-thienylmethyl)-4-(2-thienylsulfonyl)- [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: 480.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.5±3.0 kJ/mol
Flash Point: 244.4±31.5 °C
Index of Refraction: 1.637
Molar Refractivity: 90.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.61
ACD/LogD (pH 5.5): 2.08
ACD/BCF (pH 5.5): 17.22
ACD/KOC (pH 5.5): 195.45
ACD/LogD (pH 7.4): 2.55
ACD/BCF (pH 7.4): 50.29
ACD/KOC (pH 7.4): 570.76
Polar Surface Area: 105 Å2
Polarizability: 35.7±0.5 10-24cm3
Surface Tension: 57.4±3.0 dyne/cm
Molar Volume: 250.8±3.0 cm3

Click to predict properties on the Chemicalize site


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