ChemSpider 2D Image | Ethyl (2Z)-2-(acetylimino)-4-methyl-5-(1-{2-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]hydrazino}ethylidene)-2,5-dihydro-3-thiophenecarboxylate | C22H27N5O8S2

Ethyl (2Z)-2-(acetylimino)-4-methyl-5-(1-{2-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]hydrazino}ethylidene)-2,5-dihydro-3-thiophenecarboxylate

  • Molecular FormulaC22H27N5O8S2
  • Average mass553.609 Da
  • Monoisotopic mass553.130127 Da
  • ChemSpider ID5197814

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-(Acétylimino)-4-méthyl-5-(1-{2-[4-(4-morpholinylsulfonyl)-2-nitrophényl]hydrazino}éthylidène)-2,5-dihydro-3-thiophènecarboxylate d'éthyle [French] [ACD/IUPAC Name]
3-Thiophenecarboxylic acid, 2-(acetylimino)-2,5-dihydro-4-methyl-5-[1-[2-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]hydrazinyl]ethylidene]-, ethyl ester, (2Z)- [ACD/Index Name]
Ethyl (2Z)-2-(acetylimino)-4-methyl-5-(1-{2-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]hydrazino}ethylidene)-2,5-dihydro-3-thiophenecarboxylate [ACD/IUPAC Name]
Ethyl-(2Z)-2-(acetylimino)-4-methyl-5-(1-{2-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]hydrazino}ethyliden)-2,5-dihydro-3-thiophencarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 630.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.2±3.0 kJ/mol
Flash Point: 334.9±34.3 °C
Index of Refraction: 1.659
Molar Refractivity: 136.4±0.5 cm3
#H bond acceptors: 13
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 3.39
ACD/LogD (pH 5.5): 2.92
ACD/BCF (pH 5.5): 96.93
ACD/KOC (pH 5.5): 919.41
ACD/LogD (pH 7.4): 2.92
ACD/BCF (pH 7.4): 96.93
ACD/KOC (pH 7.4): 919.41
Polar Surface Area: 206 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 59.8±7.0 dyne/cm
Molar Volume: 369.8±7.0 cm3

Click to predict properties on the Chemicalize site


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