ChemSpider 2D Image | 2-Methyl-2-propanyl 2-(2-{[(4'-methoxy-4-biphenylyl)sulfonyl]amino}ethyl)-1-naphthoate | C30H31NO5S

2-Methyl-2-propanyl 2-(2-{[(4'-methoxy-4-biphenylyl)sulfonyl]amino}ethyl)-1-naphthoate

  • Molecular FormulaC30H31NO5S
  • Average mass517.636 Da
  • Monoisotopic mass517.192322 Da
  • ChemSpider ID9115497

More details:

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

1-Naphthalenecarboxylic acid, 2-[2-[[(4'-methoxy[1,1'-biphenyl]-4-yl)sulfonyl]amino]ethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-(2-{[(4'-Méthoxy-4-biphénylyl)sulfonyl]amino}éthyl)-1-naphtoate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 2-(2-{[(4'-methoxy-4-biphenylyl)sulfonyl]amino}ethyl)-1-naphthoate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-(2-{[(4'-methoxy-4-biphenylyl)sulfonyl]amino}ethyl)-1-naphthoat [German] [ACD/IUPAC 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: 690.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.1±3.0 kJ/mol
Flash Point: 371.2±34.3 °C
Index of Refraction: 1.602
Molar Refractivity: 146.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 7.06
ACD/LogD (pH 5.5): 6.62
ACD/BCF (pH 5.5): 63721.78
ACD/KOC (pH 5.5): 95607.01
ACD/LogD (pH 7.4): 6.62
ACD/BCF (pH 7.4): 63707.86
ACD/KOC (pH 7.4): 95586.13
Polar Surface Area: 90 Å2
Polarizability: 58.2±0.5 10-24cm3
Surface Tension: 47.1±3.0 dyne/cm
Molar Volume: 428.1±3.0 cm3

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