ChemSpider 2D Image | BIS-ISOPROPYLACETOMETHYL BENZATHINE | C26H36N2O4

BIS-ISOPROPYLACETOMETHYL BENZATHINE

  • Molecular FormulaC26H36N2O4
  • Average mass440.575 Da
  • Monoisotopic mass440.267517 Da
  • ChemSpider ID32699760

More details:

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

158069-88-6 [RN]
2,2'-[1,2-Éthanediylbis(benzylimino)]diacétate de diisopropyle [French] [ACD/IUPAC Name]
2,2'-[1,2-Éthanediylbis(benzylimino)]diacétate de diisopropyle (non-preferred name) [French] [ACD/IUPAC Name]
BIS-ISOPROPYLACETOMETHYL BENZATHINE
Diisopropyl 2,2'-[1,2-ethanediylbis(benzylimino)]diacetate [ACD/IUPAC Name]
Diisopropyl 2,2'-[1,2-ethanediylbis(benzylimino)]diacetate (non-preferred name) [ACD/IUPAC Name]
Diisopropyl-2,2'-[1,2-ethandiylbis(benzylimino)]diacetat [German] [ACD/IUPAC Name]
Diisopropyl-2,2'-[1,2-ethandiylbis(benzylimino)]diacetat (non-preferred name) [German] [ACD/IUPAC Name]

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

H9UT0KZO8S [DBID]
UNII:H9UT0KZO8S [DBID]
UNII-H9UT0KZO8S [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 513.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.5±3.0 kJ/mol
Flash Point: 264.3±30.1 °C
Index of Refraction: 1.541
Molar Refractivity: 126.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 7.36
ACD/LogD (pH 5.5): 4.86
ACD/BCF (pH 5.5): 2532.79
ACD/KOC (pH 5.5): 8037.81
ACD/LogD (pH 7.4): 5.11
ACD/BCF (pH 7.4): 4520.81
ACD/KOC (pH 7.4): 14346.81
Polar Surface Area: 59 Å2
Polarizability: 50.3±0.5 10-24cm3
Surface Tension: 42.4±3.0 dyne/cm
Molar Volume: 403.3±3.0 cm3

Click to predict properties on the Chemicalize site


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