Found 282 results

Search term: MF = 'C_{35}H_{38}N_{2}O_{5}'
ChemSpider 2D Image | 2-Amino-4-[4-(benzyloxy)-3-methoxyphenyl]-3-cyano-4H-chromen-7-yl 4-butylcyclohexanecarboxylate | C35H38N2O5

2-Amino-4-[4-(benzyloxy)-3-methoxyphenyl]-3-cyano-4H-chromen-7-yl 4-butylcyclohexanecarboxylate

  • Molecular FormulaC35H38N2O5
  • Average mass566.687 Da
  • Monoisotopic mass566.278076 Da
  • ChemSpider ID12017369

More details:

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

2-Amino-4-[4-(benzyloxy)-3-methoxyphenyl]-3-cyan-4H-chromen-7-yl-4-butylcyclohexancarboxylat [German] [ACD/IUPAC Name]
2-Amino-4-[4-(benzyloxy)-3-methoxyphenyl]-3-cyano-4H-chromen-7-yl 4-butylcyclohexanecarboxylate [ACD/IUPAC Name]
4-Butylcyclohexanecarboxylate de 2-amino-4-[4-(benzyloxy)-3-méthoxyphényl]-3-cyano-4H-chromén-7-yle [French] [ACD/IUPAC Name]
Cyclohexanecarboxylic acid, 4-butyl-, 2-amino-3-cyano-4-[3-methoxy-4-(phenylmethoxy)phenyl]-4H-1-benzopyran-7-yl ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 714.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.5±3.0 kJ/mol
Flash Point: 386.1±32.9 °C
Index of Refraction: 1.619
Molar Refractivity: 160.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 7.92
ACD/LogD (pH 5.5): 7.25
ACD/BCF (pH 5.5): 189013.81
ACD/KOC (pH 5.5): 208101.39
ACD/LogD (pH 7.4): 7.25
ACD/BCF (pH 7.4): 189339.30
ACD/KOC (pH 7.4): 208459.73
Polar Surface Area: 104 Å2
Polarizability: 63.8±0.5 10-24cm3
Surface Tension: 58.2±5.0 dyne/cm
Molar Volume: 458.3±5.0 cm3

Click to predict properties on the Chemicalize site


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