Found 1 result

Search term: ORSJIQSXTAJDMZ-VIFPVBQESA-N (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (4-Methyl-1-azepanyl)(1,3-thiazol-4-yl)methanone | C11H16N2OS

(4-Methyl-1-azepanyl)(1,3-thiazol-4-yl)methanone

  • Molecular FormulaC11H16N2OS
  • Average mass224.322 Da
  • Monoisotopic mass224.098328 Da
  • ChemSpider ID31826414

More details:

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

(4-Methyl-1-azepanyl)(1,3-thiazol-4-yl)methanon [German] [ACD/IUPAC Name]
(4-Methyl-1-azepanyl)(1,3-thiazol-4-yl)methanone [ACD/IUPAC Name]
(4-Méthyl-1-azépanyl)(1,3-thiazol-4-yl)méthanone [French] [ACD/IUPAC Name]
Methanone, (hexahydro-4-methyl-1H-azepin-1-yl)-4-thiazolyl- [ACD/Index Name]
1389617-98-4 [RN]
4-methyl-1-(1,3-thiazole-4-carbonyl)azepane
MFCD19500647

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

Density: 1.2±0.1 g/cm3
Boiling Point: 370.3±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.7±3.0 kJ/mol
Flash Point: 177.8±20.4 °C
Index of Refraction: 1.550
Molar Refractivity: 62.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.66
ACD/LogD (pH 5.5): 1.19
ACD/BCF (pH 5.5): 4.75
ACD/KOC (pH 5.5): 106.16
ACD/LogD (pH 7.4): 1.19
ACD/BCF (pH 7.4): 4.75
ACD/KOC (pH 7.4): 106.17
Polar Surface Area: 61 Å2
Polarizability: 24.6±0.5 10-24cm3
Surface Tension: 44.9±3.0 dyne/cm
Molar Volume: 195.0±3.0 cm3

Click to predict properties on the Chemicalize site


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