ChemSpider 2D Image | N-[(5-Methyl-2-thienyl)methyl]-4-thiochromanamine | C15H17NS2

N-[(5-Methyl-2-thienyl)methyl]-4-thiochromanamine

  • Molecular FormulaC15H17NS2
  • Average mass275.432 Da
  • Monoisotopic mass275.080231 Da
  • ChemSpider ID34454240

More details:

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

2H-1-Benzothiopyran-4-amine, 3,4-dihydro-N-[(5-methyl-2-thienyl)methyl]- [ACD/Index Name]
N-[(5-Methyl-2-thienyl)methyl]-4-thiochromanamin [German] [ACD/IUPAC Name]
N-[(5-Methyl-2-thienyl)methyl]-4-thiochromanamine [ACD/IUPAC Name]
N-[(5-Méthyl-2-thiényl)méthyl]-4-thiochromanamine [French] [ACD/IUPAC Name]
1152718-47-2 [RN]
MFCD12565303
N-[(5-methylthiophen-2-yl)methyl]-3,4-dihydro-2H-1-benzothiopyran-4-amine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 400.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.1±3.0 kJ/mol
Flash Point: 195.9±28.7 °C
Index of Refraction: 1.653
Molar Refractivity: 82.3±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.23
ACD/LogD (pH 5.5): 2.28
ACD/BCF (pH 5.5): 11.30
ACD/KOC (pH 5.5): 57.82
ACD/LogD (pH 7.4): 3.86
ACD/BCF (pH 7.4): 427.01
ACD/KOC (pH 7.4): 2184.30
Polar Surface Area: 66 Å2
Polarizability: 32.6±0.5 10-24cm3
Surface Tension: 53.4±5.0 dyne/cm
Molar Volume: 225.0±5.0 cm3

Click to predict properties on the Chemicalize site


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