Found 282 results

Search term: MF = 'C_{35}H_{38}N_{2}O_{5}'
ChemSpider 2D Image | 2-Amino-3-cyano-4-[3-methoxy-4-(3-methylbutoxy)phenyl]-4H-chromen-7-yl (2E)-3-(4-tert-butylphenyl)acrylate | C35H38N2O5

2-Amino-3-cyano-4-[3-methoxy-4-(3-methylbutoxy)phenyl]-4H-chromen-7-yl (2E)-3-(4-tert-butylphenyl)acrylate

  • Molecular FormulaC35H38N2O5
  • Average mass566.687 Da
  • Monoisotopic mass566.278076 Da
  • ChemSpider ID12012066

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-[4-(2-Méthyl-2-propanyl)phényl]acrylate de 2-amino-3-cyano-4-[3-méthoxy-4-(3-méthylbutoxy)phényl]-4H-chromén-7-yle [French] [ACD/IUPAC Name]
2-Amino-3-cyan-4-[3-methoxy-4-(3-methylbutoxy)phenyl]-4H-chromen-7-yl-(2E)-3-[4-(2-methyl-2-propanyl)phenyl]acrylat [German] [ACD/IUPAC Name]
2-Amino-3-cyano-4-[3-methoxy-4-(3-methylbutoxy)phenyl]-4H-chromen-7-yl (2E)-3-(4-tert-butylphenyl)acrylate
2-Amino-3-cyano-4-[3-methoxy-4-(3-methylbutoxy)phenyl]-4H-chromen-7-yl (2E)-3-[4-(2-methyl-2-propanyl)phenyl]acrylate [ACD/IUPAC Name]
2-Propenoic acid, 3-[4-(1,1-dimethylethyl)phenyl]-, 2-amino-3-cyano-4-[3-methoxy-4-(3-methylbutoxy)phenyl]-4H-1-benzopyran-7-yl ester, (2E)- [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: 706.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.4±3.0 kJ/mol
Flash Point: 381.2±32.9 °C
Index of Refraction: 1.610
Molar Refractivity: 162.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 8.27
ACD/LogD (pH 5.5): 7.23
ACD/BCF (pH 5.5): 183638.89
ACD/KOC (pH 5.5): 203875.39
ACD/LogD (pH 7.4): 7.23
ACD/BCF (pH 7.4): 183870.09
ACD/KOC (pH 7.4): 204132.08
Polar Surface Area: 104 Å2
Polarizability: 64.5±0.5 10-24cm3
Surface Tension: 55.0±5.0 dyne/cm
Molar Volume: 469.8±5.0 cm3

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