ChemSpider 2D Image | 1-[3-(Aminomethyl)phenyl]-3-(4-pyridinylmethyl)urea | C14H16N4O

1-[3-(Aminomethyl)phenyl]-3-(4-pyridinylmethyl)urea

  • Molecular FormulaC14H16N4O
  • Average mass256.303 Da
  • Monoisotopic mass256.132416 Da
  • ChemSpider ID25994518

More details:

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

1-[3-(Aminomethyl)phenyl]-3-(4-pyridinylmethyl)harnstoff [German] [ACD/IUPAC Name]
1-[3-(Aminomethyl)phenyl]-3-(4-pyridinylmethyl)urea [ACD/IUPAC Name]
1-[3-(Aminométhyl)phényl]-3-(4-pyridinylméthyl)urée [French] [ACD/IUPAC Name]
Urea, N-[3-(aminomethyl)phenyl]-N'-(4-pyridinylmethyl)- [ACD/Index Name]
1-[3-(aminomethyl)phenyl]-3-(pyridin-4-ylmethyl)urea
1094683-17-6 [RN]
3-[3-(AMINOMETHYL)PHENYL]-1-(PYRIDIN-4-YLMETHYL)UREA
3-[3-(aminomethyl)phenyl]-1-[(pyridin-4-yl)methyl]urea
MFCD12550861 [MDL number]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 452.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.1±3.0 kJ/mol
Flash Point: 227.3±28.7 °C
Index of Refraction: 1.653
Molar Refractivity: 75.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.26
ACD/LogD (pH 5.5): -2.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.45
Polar Surface Area: 80 Å2
Polarizability: 29.8±0.5 10-24cm3
Surface Tension: 60.0±3.0 dyne/cm
Molar Volume: 205.2±3.0 cm3

Click to predict properties on the Chemicalize site


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