ChemSpider 2D Image | N,N',N''-[Benzene-1,3,5-triyltris(methylene)]tris(2,3-dihydroxybenzamide) | C30H27N3O9

N,N',N''-[Benzene-1,3,5-triyltris(methylene)]tris(2,3-dihydroxybenzamide)

  • Molecular FormulaC30H27N3O9
  • Average mass573.550 Da
  • Monoisotopic mass573.174744 Da
  • ChemSpider ID168589

More details:






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

Benzamide, N,N',N''-[benzene-1,3,5-triyltris(methylene)]tris[2,3-dihydroxy- [ACD/Index Name]
N,N',N''-(Benzène-1,3,5-triyltriméthylène)tris(2,3-dihydroxybenzamide) [French] [ACD/IUPAC Name]
N,N',N''-(Benzol-1,3,5-triyltrimethylen)tris(2,3-dihydroxybenzamid) [German] [ACD/IUPAC Name]
N,N',N''-[Benzene-1,3,5-triyltris(methylene)]tris(2,3-dihydroxybenzamide) [ACD/IUPAC Name]
1,3,5-tris((N,N',N''-2,3-dihydroxybenzoyl)aminomethyl)benzene
1,3,5-Tris(2,3-dihydroxybenzamidomethyl)benzene
69146-59-4 [RN]
Benzamide, N,N',N''-(1,3,5-benzenetriyltris(methylene))tris(2,3-dihydroxy-
ECA
MECAM
More...

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

AIDS129208 [DBID]
AIDS-129208 [DBID]
NSC 337598 [DBID]
NSC337598 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 903.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 135.7±3.0 kJ/mol
Flash Point: 499.9±34.3 °C
Index of Refraction: 1.723
Molar Refractivity: 151.9±0.3 cm3
#H bond acceptors: 12
#H bond donors: 9
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: 4.78
ACD/LogD (pH 5.5): 3.70
ACD/BCF (pH 5.5): 381.07
ACD/KOC (pH 5.5): 2446.49
ACD/LogD (pH 7.4): 3.62
ACD/BCF (pH 7.4): 315.79
ACD/KOC (pH 7.4): 2027.38
Polar Surface Area: 209 Å2
Polarizability: 60.2±0.5 10-24cm3
Surface Tension: 82.1±3.0 dyne/cm
Molar Volume: 383.2±3.0 cm3

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