ChemSpider 2D Image | 1-[4-(3-Aminopropyl)-1,4-diazepan-1-yl]ethanone | C10H21N3O

1-[4-(3-Aminopropyl)-1,4-diazepan-1-yl]ethanone

  • Molecular FormulaC10H21N3O
  • Average mass199.293 Da
  • Monoisotopic mass199.168457 Da
  • ChemSpider ID22516128

More details:

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

1-[4-(3-Aminopropyl)-1,4-diazepan-1-yl]ethanon [German] [ACD/IUPAC Name]
1-[4-(3-Aminopropyl)-1,4-diazepan-1-yl]ethanone [ACD/IUPAC Name]
1-[4-(3-Aminopropyl)-1,4-diazépan-1-yl]éthanone [French] [ACD/IUPAC Name]
1-[4-(3-Aminopropyl)hexahydro-1H-1,4-diazepin-1-yl]ethanone
928003-94-5 [RN]
Ethanone, 1-[4-(3-aminopropyl)hexahydro-1H-1,4-diazepin-1-yl]- [ACD/Index Name]
T7N DNTJ AV1 D3Z [WLN]
1-[4-(3-aminopropyl)-1,4-diazepan-1-yl]ethan-1-one
1-Acetyl-4-(3-aminopropyl)-1,4-diazaperhydroepine
3-(4-acetyl-1,4-diazepan-1-yl)propan-1-amine
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 350.9±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.6±3.0 kJ/mol
Flash Point: 166.0±26.5 °C
Index of Refraction: 1.494
Molar Refractivity: 56.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.41
ACD/LogD (pH 5.5): -4.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 50 Å2
Polarizability: 22.6±0.5 10-24cm3
Surface Tension: 39.1±3.0 dyne/cm
Molar Volume: 195.3±3.0 cm3

Click to predict properties on the Chemicalize site


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