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Search term: XSNQNOREQBURFG (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Dimethyl 5-{[(3,5-dichlorophenoxy)acetyl]amino}isophthalate | C18H15Cl2NO6

Dimethyl 5-{[(3,5-dichlorophenoxy)acetyl]amino}isophthalate

  • Molecular FormulaC18H15Cl2NO6
  • Average mass412.221 Da
  • Monoisotopic mass411.027649 Da
  • ChemSpider ID21980411

More details:

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

1,3-Benzenedicarboxylic acid, 5-[[2-(3,5-dichlorophenoxy)acetyl]amino]-, dimethyl ester [ACD/Index Name]
5-{[2-(3,5-Dichlorophénoxy)acétyl]amino}isophtalate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 5-{[(3,5-dichlorophenoxy)acetyl]amino}isophthalate [ACD/IUPAC Name]
Dimethyl-5-{[(3,5-dichlorphenoxy)acetyl]amino}isophthalat [German] [ACD/IUPAC 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: 605.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.0±3.0 kJ/mol
Flash Point: 319.8±31.5 °C
Index of Refraction: 1.605
Molar Refractivity: 100.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.43
ACD/LogD (pH 5.5): 4.76
ACD/BCF (pH 5.5): 2443.79
ACD/KOC (pH 5.5): 9263.44
ACD/LogD (pH 7.4): 4.76
ACD/BCF (pH 7.4): 2443.75
ACD/KOC (pH 7.4): 9263.28
Polar Surface Area: 91 Å2
Polarizability: 39.7±0.5 10-24cm3
Surface Tension: 53.1±3.0 dyne/cm
Molar Volume: 290.6±3.0 cm3

Click to predict properties on the Chemicalize site


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