Found 1932 results

Search term: MF = 'C_{29}H_{32}N_{4}O_{5}'
ChemSpider 2D Image | 2,2'-{(7-Oxo-2,4,10,12-tetraoxadispiro[5.1.5.2]pentadecane-3,11-diyl)bis[4,1-phenylene(methylimino)]}diacetonitrile | C29H32N4O5

2,2'-{(7-Oxo-2,4,10,12-tetraoxadispiro[5.1.5.2]pentadecane-3,11-diyl)bis[4,1-phenylene(methylimino)]}diacetonitrile

  • Molecular FormulaC29H32N4O5
  • Average mass516.588 Da
  • Monoisotopic mass516.237244 Da
  • ChemSpider ID1735342

More details:

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

2,2'-{(7-Oxo-2,4,10,12-tetraoxadispiro[5.1.5.2]pentadecan-3,11-diyl)bis[4,1-phenylen(methylimino)]}diacetonitril [German] [ACD/IUPAC Name]
2,2'-{(7-Oxo-2,4,10,12-tetraoxadispiro[5.1.5.2]pentadecane-3,11-diyl)bis[4,1-phenylene(methylimino)]}diacetonitrile [ACD/IUPAC Name]
2,2'-{(7-Oxo-2,4,10,12-tétraoxadispiro[5.1.5.2]pentadécane-3,11-diyl)bis[4,1-phénylène(méthylimino)]}diacétonitrile [French] [ACD/IUPAC Name]
Acetonitrile, 2,2'-[(7-oxo-2,4,10,12-tetraoxadispiro[5.1.5.2]pentadecane-3,11-diyl)bis[4,1-phenylene(methylimino)]]bis- [ACD/Index Name]
2-[4-[11-[4-[CYANOMETHYL(METHYL)AMINO]PHENYL]-7-OXO-2,4,10,12-TETRAOXADISPIRO[5.1.5λ(8).2λ(6)]PENTADECAN-3-YL]-N-METHYLANILINO]ACETONITRILE

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

ZINC03194243 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 754.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.0±3.0 kJ/mol
Flash Point: 410.3±32.9 °C
Index of Refraction: 1.626
Molar Refractivity: 138.8±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.54
ACD/LogD (pH 5.5): 2.57
ACD/BCF (pH 5.5): 52.94
ACD/KOC (pH 5.5): 596.30
ACD/LogD (pH 7.4): 2.57
ACD/BCF (pH 7.4): 52.94
ACD/KOC (pH 7.4): 596.34
Polar Surface Area: 108 Å2
Polarizability: 55.0±0.5 10-24cm3
Surface Tension: 65.0±5.0 dyne/cm
Molar Volume: 392.0±5.0 cm3

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