ChemSpider 2D Image | 2-(1H-Benzotriazol-1-yl)-N-{1-(4-ethoxyphenyl)-2-oxo-2-[(tetrahydro-2-furanylmethyl)amino]ethyl}-N-(tetrahydro-2-furanylmethyl)acetamide | C28H35N5O5

2-(1H-Benzotriazol-1-yl)-N-{1-(4-ethoxyphenyl)-2-oxo-2-[(tetrahydro-2-furanylmethyl)amino]ethyl}-N-(tetrahydro-2-furanylmethyl)acetamide

  • Molecular FormulaC28H35N5O5
  • Average mass521.608 Da
  • Monoisotopic mass521.263794 Da
  • ChemSpider ID2442639

More details:

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

1H-1,2,3-Benzotriazole-1-acetamide, N-[1-(4-ethoxyphenyl)-2-oxo-2-[[(tetrahydro-2-furanyl)methyl]amino]ethyl]-N-[(tetrahydro-2-furanyl)methyl]- [ACD/Index Name]
2-(1H-Benzotriazol-1-yl)-N-{1-(4-ethoxyphenyl)-2-oxo-2-[(tetrahydro-2-furanylmethyl)amino]ethyl}-N-(tetrahydro-2-furanylmethyl)acetamid [German] [ACD/IUPAC Name]
2-(1H-Benzotriazol-1-yl)-N-{1-(4-ethoxyphenyl)-2-oxo-2-[(tetrahydro-2-furanylmethyl)amino]ethyl}-N-(tetrahydro-2-furanylmethyl)acetamide [ACD/IUPAC Name]
2-(1H-Benzotriazol-1-yl)-N-{1-(4-éthoxyphényl)-2-oxo-2-[(tétrahydro-2-furanylméthyl)amino]éthyl}-N-(tétrahydro-2-furanylméthyl)acétamide [French] [ACD/IUPAC Name]

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

ASN 04884986 [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: 787.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.6±3.0 kJ/mol
Flash Point: 430.2±32.9 °C
Index of Refraction: 1.648
Molar Refractivity: 141.6±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 2.34
ACD/LogD (pH 5.5): 2.28
ACD/BCF (pH 5.5): 31.94
ACD/KOC (pH 5.5): 415.34
ACD/LogD (pH 7.4): 2.28
ACD/BCF (pH 7.4): 31.94
ACD/KOC (pH 7.4): 415.36
Polar Surface Area: 108 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 53.2±7.0 dyne/cm
Molar Volume: 389.0±7.0 cm3

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