ChemSpider 2D Image | 2-Methyl-2-propanyl (3-{4-[3-(3,4-dimethoxyphenyl)propanoyl]-1,4-diazepan-1-yl}-3-oxopropyl)carbamate | C24H37N3O6

2-Methyl-2-propanyl (3-{4-[3-(3,4-dimethoxyphenyl)propanoyl]-1,4-diazepan-1-yl}-3-oxopropyl)carbamate

  • Molecular FormulaC24H37N3O6
  • Average mass463.567 Da
  • Monoisotopic mass463.268250 Da
  • ChemSpider ID34638000

More details:

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

(3-{4-[3-(3,4-Diméthoxyphényl)propanoyl]-1,4-diazépan-1-yl}-3-oxopropyl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (3-{4-[3-(3,4-dimethoxyphenyl)propanoyl]-1,4-diazepan-1-yl}-3-oxopropyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(3-{4-[3-(3,4-dimethoxyphenyl)propanoyl]-1,4-diazepan-1-yl}-3-oxopropyl)carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[3-[4-[3-(3,4-dimethoxyphenyl)-1-oxopropyl]hexahydro-1H-1,4-diazepin-1-yl]-3-oxopropyl]-, 1,1-dimethylethyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 664.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.7±3.0 kJ/mol
Flash Point: 355.5±31.5 °C
Index of Refraction: 1.525
Molar Refractivity: 124.2±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.58
ACD/LogD (pH 5.5): 2.32
ACD/BCF (pH 5.5): 33.89
ACD/KOC (pH 5.5): 433.32
ACD/LogD (pH 7.4): 2.32
ACD/BCF (pH 7.4): 33.89
ACD/KOC (pH 7.4): 433.32
Polar Surface Area: 97 Å2
Polarizability: 49.2±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 405.4±3.0 cm3

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