ChemSpider 2D Image | Iscotrizinol | C44H59N7O5


  • Molecular FormulaC44H59N7O5
  • Average mass765.983 Da
  • Monoisotopic mass765.457764 Da
  • ChemSpider ID7986571

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Iscotrizinol [USAN] [Wiki]
154702-15-5 [RN]
4,4-[[6-[[4-[[(1,1-Dimethylethyl)amino]carbonyl]phenyl]amino]-1,3,5-triazine-2,4-diyl]diimino]bisbenzoic acid 1,1'-bis(2-ethylhexyl) ester
4,4'-{[6-({4-[(2-Méthyl-2-propanyl)carbamoyl]phényl}amino)-1,3,5-triazine-2,4-diyl]diimino}dibenzoate de bis(2-éthylhexyle) [French] [ACD/IUPAC Name]
Benzoic acid, 4,4'-[[6-[[4-[[(1,1-dimethylethyl)amino]carbonyl]phenyl]amino]- 1,3,5-triazine-2,4-diyl]diimino]bis-, bis(2-ethylhexyl) ester
Benzoic acid, 4,4'-[[6-[[4-[[(1,1-dimethylethyl)amino]carbonyl]phenyl]amino]-1,3,5-triazine-2,4-diyl]diimino]bis-, bis(2-ethylhexyl) ester [ACD/Index Name]
bis(2-ethylhexyl) 4,4'-[(6-{[4-(tert-butylcarbamoyl)phenyl]amino}-1,3,5- triazine-2,4-diyl)diimino]dibenzoate
Bis(2-ethylhexyl) 4,4'-[(6-{[4-(tert-butylcarbamoyl)phenyl]amino}-1,3,5-triazine-2,4-diyl)diimino]dibenzoate

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

11322517 [Beilstein] [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.590
Molar Refractivity: 224.5±0.3 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 3
ACD/LogP: 11.89
ACD/LogD (pH 5.5): 10.18
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 8207768.50
ACD/LogD (pH 7.4): 10.18
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 8208246.00
Polar Surface Area: 156 Å2
Polarizability: 89.0±0.5 10-24cm3
Surface Tension: 49.0±3.0 dyne/cm
Molar Volume: 664.8±3.0 cm3

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