Found 3 results

Search term: XBJUGAJTMFCPPS (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-Ethoxy-4-[(Z)-(3-methyl-5-oxo-1,2-oxazol-4(5H)-ylidene)methyl]phenyl 2-thiophenecarboxylate | C18H15NO5S

2-Ethoxy-4-[(Z)-(3-methyl-5-oxo-1,2-oxazol-4(5H)-ylidene)methyl]phenyl 2-thiophenecarboxylate

  • Molecular FormulaC18H15NO5S
  • Average mass357.380 Da
  • Monoisotopic mass357.067108 Da
  • ChemSpider ID28334415

  • Double-bond stereo - Double-bond stereo

More details:

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

2-Ethoxy-4-[(Z)-(3-methyl-5-oxo-1,2-oxazol-4(5H)-yliden)methyl]phenyl-2-thiophencarboxylat [German] [ACD/IUPAC Name]
2-Ethoxy-4-[(Z)-(3-methyl-5-oxo-1,2-oxazol-4(5H)-ylidene)methyl]phenyl 2-thiophenecarboxylate [ACD/IUPAC Name]
2-Thiophènecarboxylate de 2-éthoxy-4-[(Z)-(3-méthyl-5-oxo-1,2-oxazol-4(5H)-ylidène)méthyl]phényle [French] [ACD/IUPAC Name]
2-Thiophenecarboxylic acid, 2-ethoxy-4-[(Z)-(3-methyl-5-oxo-4(5H)-isoxazolylidene)methyl]phenyl ester [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 548.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.9±3.0 kJ/mol
Flash Point: 285.8±32.9 °C
Index of Refraction: 1.620
Molar Refractivity: 94.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.62
ACD/LogD (pH 5.5): 3.63
ACD/BCF (pH 5.5): 335.94
ACD/KOC (pH 5.5): 2238.21
ACD/LogD (pH 7.4): 3.63
ACD/BCF (pH 7.4): 335.94
ACD/KOC (pH 7.4): 2238.21
Polar Surface Area: 102 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 48.5±7.0 dyne/cm
Molar Volume: 268.3±7.0 cm3

Click to predict properties on the Chemicalize site


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