Found 301 results

Search term: MF = 'C_{29}H_{30}ClN_{5}O_{4}'
ChemSpider 2D Image | 2-{4-(2H-Benzotriazol-2-ylacetyl)-2-[(4-chlorophenoxy)methyl]-2-morpholinyl}-N-benzyl-N-methylacetamide | C29H30ClN5O4

2-{4-(2H-Benzotriazol-2-ylacetyl)-2-[(4-chlorophenoxy)methyl]-2-morpholinyl}-N-benzyl-N-methylacetamide

  • Molecular FormulaC29H30ClN5O4
  • Average mass548.033 Da
  • Monoisotopic mass547.198608 Da
  • ChemSpider ID68643048

More details:

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

2-{4-(2H-Benzotriazol-2-ylacetyl)-2-[(4-chlorophenoxy)methyl]-2-morpholinyl}-N-benzyl-N-methylacetamide [ACD/IUPAC Name]
2-{4-(2H-Benzotriazol-2-ylacetyl)-2-[(4-chlorphenoxy)methyl]-2-morpholinyl}-N-benzyl-N-methylacetamid [German] [ACD/IUPAC Name]
2-{4-[2-(2H-Benzotriazol-2-yl)acétyl]-2-[(4-chlorophénoxy)méthyl]-2-morpholinyl}-N-benzyl-N-méthylacétamide [French] [ACD/IUPAC Name]
2-Morpholineacetamide, 4-[2-(2H-1,2,3-benzotriazol-2-yl)acetyl]-2-[(4-chlorophenoxy)methyl]-N-methyl-N-(phenylmethyl)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 759.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 110.6±3.0 kJ/mol
Flash Point: 412.9±35.7 °C
Index of Refraction: 1.639
Molar Refractivity: 150.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.20
ACD/LogD (pH 5.5): 4.73
ACD/BCF (pH 5.5): 2318.72
ACD/KOC (pH 5.5): 8921.33
ACD/LogD (pH 7.4): 4.73
ACD/BCF (pH 7.4): 2318.93
ACD/KOC (pH 7.4): 8922.14
Polar Surface Area: 90 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 52.4±7.0 dyne/cm
Molar Volume: 419.3±7.0 cm3

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