ChemSpider 2D Image | DBCO-NH2 | C18H16N2O

DBCO-NH2

  • Molecular FormulaC18H16N2O
  • Average mass276.332 Da
  • Monoisotopic mass276.126251 Da
  • ChemSpider ID26998311

More details:

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

1255942-06-3 [RN]
1-Propanone, 3-amino-1-(11,12-didehydrodibenz[b,f]azocin-5(6H)-yl)- [ACD/Index Name]
3-Amino-1-(11,12-didehydrodibenzo[b,f]azocin-5(6H)-yl)-1-propanon [German] [ACD/IUPAC Name]
3-Amino-1-(11,12-didehydrodibenzo[b,f]azocin-5(6H)-yl)-1-propanone [ACD/IUPAC Name]
3-Amino-1-(11,12-didéhydrodibenzo[b,f]azocin-5(6H)-yl)-1-propanone [French] [ACD/IUPAC Name]
DBCO-amine
DBCO-NH2
Dibenzocyclooctyne-amine
MFCD22380759
3-Amino-1-[(5-aza-3,4:7,8-dibenzocyclooct-1-yne)-5-yl]-1-propanone
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 549.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.0±3.0 kJ/mol
Flash Point: 286.4±30.1 °C
Index of Refraction: 1.679
Molar Refractivity: 82.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.58
ACD/LogD (pH 5.5): -0.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.34
ACD/LogD (pH 7.4): 1.62
ACD/BCF (pH 7.4): 5.47
ACD/KOC (pH 7.4): 57.19
Polar Surface Area: 46 Å2
Polarizability: 32.8±0.5 10-24cm3
Surface Tension: 65.3±5.0 dyne/cm
Molar Volume: 219.3±5.0 cm3

Click to predict properties on the Chemicalize site


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