ChemSpider 2D Image | 1,1',1'',1'''-(1,2-Ethanediyldinitrilo)tetrakis(3-phenoxy-2-propanol) | C38H48N2O8

1,1',1'',1'''-(1,2-Ethanediyldinitrilo)tetrakis(3-phenoxy-2-propanol)

  • Molecular FormulaC38H48N2O8
  • Average mass660.796 Da
  • Monoisotopic mass660.341064 Da
  • ChemSpider ID3236822

More details:

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

1,1',1'',1'''-(1,2-Ethandiyldinitrilo)tetrakis(3-phenoxy-2-propanol) [German] [ACD/IUPAC Name]
1,1',1'',1'''-(1,2-Ethanediyldinitrilo)tetrakis(3-phenoxy-2-propanol) [ACD/IUPAC Name]
1,1',1'',1'''-(1,2-Éthanediyldinitrilo)tétrakis(3-phénoxy-2-propanol) [French] [ACD/IUPAC Name]
2-Propanol, 1,1',1'',1'''-(1,2-ethanediyldinitrilo)tetrakis[3-phenoxy- [ACD/Index Name]
1-({2-[bis(2-hydroxy-3-phenoxypropyl)amino]ethyl}(2-hydroxy-3-phenoxypropyl)amino)-3-phenoxypropan-2-ol
1,1',1'',1'''-(ethane-1,2-diyldinitrilo)tetrakis(3-phenoxypropan-2-ol)
1-[{2-[bis(2-hydroxy-3-phenoxypropyl)amino]ethyl}(2-hydroxy-3-phenoxypropyl)amino]-3-phenoxy-2-propanol
1-[2-[BIS(2-HYDROXY-3-PHENOXYPROPYL)AMINO]ETHYL-(2-HYDROXY-3-PHENOXYPROPYL)AMINO]-3-PHENOXYPROPAN-2-OL

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

A2250/0094751 [DBID]
AG-205/13547041 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 764.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 116.7±3.0 kJ/mol
Flash Point: 415.9±32.9 °C
Index of Refraction: 1.603
Molar Refractivity: 185.3±0.3 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 3
ACD/LogP: 5.86
ACD/LogD (pH 5.5): 2.99
ACD/BCF (pH 5.5): 47.68
ACD/KOC (pH 5.5): 203.16
ACD/LogD (pH 7.4): 4.38
ACD/BCF (pH 7.4): 1160.61
ACD/KOC (pH 7.4): 4945.33
Polar Surface Area: 124 Å2
Polarizability: 73.5±0.5 10-24cm3
Surface Tension: 54.5±3.0 dyne/cm
Molar Volume: 539.2±3.0 cm3

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